3-[5-[4-(3,4-dimethoxyphenyl)piperidin-1-yl]-2,2,4,6,7-pentamethyl-3H-1-benzofuran-3-yl]-1,2,4,5-tetrahydro-3-benzazepine

Systemtic Name: 3-[5-[4-(3,4-dimethoxyphenyl)piperidin-1-yl]-2,2,4,6,7-pentamethyl-3H-1-benzofuran-3-yl]-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 3-[5-[4-(3,4-dimethoxyphenyl)-1-piperidyl]-2,2,4,6,7-pentamethyl-3H-benzofuran-3-yl]-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 3-[5-[4-(3,4-dimethoxyphenyl)-1-piperidinyl]-2,2,4,6,7-pentamethyl-3H-benzofuran-3-yl]-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 3-[5-[4-(3,4-dimethoxyphenyl)piperidin-1-yl]-2,2,4,6,7-pentamethyl-3H-1-benzofuran-3-yl]-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 3-[5-[4-(3,4-dimethoxyphenyl)piperidino]-2,2,4,6,7-pentamethyl-coumaran-3-yl]-1,2,4,5-tetrahydro-3-benzazepine Formula: C36H46N2O3 MolecularWeight: 554.76204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(C(OC2=C1C)(C)C)N3CCC4=CC=CC=C4CC3)C)N5CCC(CC5)C6=CC(=C(C=C6)OC)OC

Isomeric SMILES

CC1=C(C(=C2C(C(OC2=C1C)(C)C)N3CCC4=CC=CC=C4CC3)C)N5CCC(CC5)C6=CC(=C(C=C6)OC)OC

InChI

InChI=1S/C36H46N2O3/c1-23-24(2)34-32(35(36(4,5)41-34)38-20-16-26-10-8-9-11-27(26)17-21-38)25(3)33(23)37-18-14-28(15-19-37)29-12-13-30(39-6)31(22-29)40-7/h8-13,22,28,35H,14-21H2,1-7H3