3,4-dimethoxy-6-phenethyl-7,8,13,14-tetrahydro-5H-benzo[e][2]benzazecin-10-ol

Systemtic Name: 3,4-dimethoxy-6-phenethyl-7,8,13,14-tetrahydro-5H-benzo[e][2]benzazecin-10-ol Openeye Name: 3,4-dimethoxy-6-phenethyl-7,8,13,14-tetrahydro-5H-benzo[e][2]benzazecin-10-ol CAS Name: 3,4-dimethoxy-6-phenethyl-7,8,13,14-tetrahydro-5H-benzo[e][2]benzazecin-10-ol IUPAC Name: 3,4-dimethoxy-6-phenethyl-7,8,13,14-tetrahydro-5H-benzo[e][2]benzazecin-10-ol Traditional Name: 3,4-dimethoxy-6-phenethyl-7,8,13,14-tetrahydro-5H-benzo[e][2]benzazecin-10-ol Formula: C27H31NO3 MolecularWeight: 417.53994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(CCC3=C(CCN(C2)CCC4=CC=CC=C4)C=C(C=C3)O)C=C1)OC

Isomeric SMILES

COC1=C(C2=C(CCC3=C(CCN(C2)CCC4=CC=CC=C4)C=C(C=C3)O)C=C1)OC

InChI

InChI=1S/C27H31NO3/c1-30-26-13-11-22-9-8-21-10-12-24(29)18-23(21)15-17-28(19-25(22)27(26)31-2)16-14-20-6-4-3-5-7-20/h3-7,10-13,18,29H,8-9,14-17,19H2,1-2H3