(13-ethyl-2-methoxy-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) N-ethanoylsulfamate

Systemtic Name: (13-ethyl-2-methoxy-17-oxidanylidene-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) N-ethanoylsulfamate Openeye Name: (13-ethyl-2-methoxy-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) N-acetylsulfamate CAS Name: N-acetylsulfamic acid (13-ethyl-2-methoxy-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) ester IUPAC Name: (13-ethyl-2-methoxy-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) N-acetylsulfamate Traditional Name: N-acetylsulfamic acid (13-ethyl-17-keto-2-methoxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl) ester Formula: C22H29NO6S MolecularWeight: 435.53376

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Descriptors Computed from Structure

Canonical SMILES:

CCC12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)OC)OS(=O)(=O)NC(=O)C

Isomeric SMILES

CCC12CCC3C(C1CCC2=O)CCC4=CC(=C(C=C34)OC)OS(=O)(=O)NC(=O)C

InChI

InChI=1S/C22H29NO6S/c1-4-22-10-9-15-16(18(22)7-8-21(22)25)6-5-14-11-20(19(28-3)12-17(14)15)29-30(26,27)23-13(2)24/h11-12,15-16,18H,4-10H2,1-3H3,(H,23,24)