3,10,11-trimethoxy-6-(phenylmethyl)-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine

Systemtic Name: 3,10,11-trimethoxy-6-(phenylmethyl)-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine Openeye Name: 6-benzyl-3,10,11-trimethoxy-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine CAS Name: 3,10,11-trimethoxy-6-(phenylmethyl)-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine IUPAC Name: 6-benzyl-3,10,11-trimethoxy-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine Traditional Name: 6-benzyl-3,10,11-trimethoxy-6a,7,8,12b-tetrahydro-5H-benzo[a]phenanthridine Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C3C(CCC4=CC(=C(C=C34)OC)OC)N(C2)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC2=C(C=C1)C3C(CCC4=CC(=C(C=C34)OC)OC)N(C2)CC5=CC=CC=C5

InChI

InChI=1S/C27H29NO3/c1-29-21-10-11-22-20(13-21)17-28(16-18-7-5-4-6-8-18)24-12-9-19-14-25(30-2)26(31-3)15-23(19)27(22)24/h4-8,10-11,13-15,24,27H,9,12,16-17H2,1-3H3