10-(2-dimethylaminoethylamino)-7-[(2-hydroxyphenyl)methyl-methyl-amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one

Systemtic Name: 10-(2-dimethylaminoethylamino)-7-[(2-hydroxyphenyl)methyl-methyl-amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one Openeye Name: 10-(2-dimethylaminoethylamino)-7-[(2-hydroxyphenyl)methyl-methyl-amino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one CAS Name: 10-(2-dimethylaminoethylamino)-7-[(2-hydroxyphenyl)methyl-methylamino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one IUPAC Name: 10-(2-dimethylaminoethylamino)-7-[(2-hydroxyphenyl)methyl-methylamino]-1,2,3-trimethoxy-6,7-dihydro-5H-benzo[a]heptalen-9-one Traditional Name: 10-(2-dimethylaminoethylamino)-1,2,3-trimethoxy-7-[methyl(salicyl)amino]-6,7-dihydro-5H-benzo[a]heptalen-9-one Formula: C31H39N3O5 MolecularWeight: 533.65846

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNC1=CC=C2C(=CC1=O)C(CCC3=CC(=C(C(=C32)OC)OC)OC)N(C)CC4=CC=CC=C4O

Isomeric SMILES

CN(C)CCNC1=CC=C2C(=CC1=O)C(CCC3=CC(=C(C(=C32)OC)OC)OC)N(C)CC4=CC=CC=C4O

InChI

InChI=1S/C31H39N3O5/c1-33(2)16-15-32-24-13-12-22-23(18-27(24)36)25(34(3)19-21-9-7-8-10-26(21)35)14-11-20-17-28(37-4)30(38-5)31(39-6)29(20)22/h7-10,12-13,17-18,25,35H,11,14-16,19H2,1-6H3,(H,32,36)