2-(2-propoxyethoxy)ethyl N-[2-[2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethylamino]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: 2-(2-propoxyethoxy)ethyl N-[2-[2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethylamino]-2-oxidanylidene-ethyl]carbamate Openeye Name: 2-(2-propoxyethoxy)ethyl N-[2-[2-[[17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethylamino]-2-oxo-ethyl]carbamate CAS Name: N-[2-[2-[[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy-oxomethyl]amino]ethylamino]-2-oxoethyl]carbamic acid 2-(2-propoxyethoxy)ethyl ester IUPAC Name: 2-(2-propoxyethoxy)ethyl N-[2-[2-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethylamino]-2-oxoethyl]carbamate Traditional Name: N-[2-[2-[[17-(1,5-dimethylhexyl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxycarbonylamino]ethylamino]-2-keto-ethyl]carbamic acid 2-(2-propoxyethoxy)ethyl ester Formula: C40H69N3O7 MolecularWeight: 703.99176

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCOCCOC(=O)NCC(=O)NCCNC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C

Isomeric SMILES

CCCOCCOCCOC(=O)NCC(=O)NCCNC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C

InChI

InChI=1S/C40H69N3O7/c1-7-21-47-22-23-48-24-25-49-37(45)43-27-36(44)41-19-20-42-38(46)50-31-15-17-39(5)30(26-31)11-12-32-34-14-13-33(29(4)10-8-9-28(2)3)40(34,6)18-16-35(32)39/h11,28-29,31-35H,7-10,12-27H2,1-6H3,(H,41,44)(H,42,46)(H,43,45)