N-[(3,4-dichlorophenyl)methyl]-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-amine

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-amine Openeye Name: N-[(3,4-dichlorophenyl)methyl]-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-amine CAS Name: N-[(3,4-dichlorophenyl)methyl]-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-amine IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-amine Traditional Name: (3,4-dichlorobenzyl)-(3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl)amine Formula: C26H31Cl2NO MolecularWeight: 444.43644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2NCC4=CC(=C(C=C4)Cl)Cl)CCC5=C3C=CC(=C5)OC

Isomeric SMILES

CC12CCC3C(C1CCC2NCC4=CC(=C(C=C4)Cl)Cl)CCC5=C3C=CC(=C5)OC

InChI

InChI=1S/C26H31Cl2NO/c1-26-12-11-20-19-7-5-18(30-2)14-17(19)4-6-21(20)22(26)8-10-25(26)29-15-16-3-9-23(27)24(28)13-16/h3,5,7,9,13-14,20-22,25,29H,4,6,8,10-12,15H2,1-2H3