1-(2-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-5,7-dimethyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

Systemtic Name: 1-(2-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-5,7-dimethyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Openeye Name: 1-(4-benzyloxy-2-bromo-5-methoxy-phenyl)-5,7-dimethyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole CAS Name: 1-(2-bromo-5-methoxy-4-phenylmethoxyphenyl)-5,7-dimethyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole IUPAC Name: 1-(2-bromo-5-methoxy-4-phenylmethoxyphenyl)-5,7-dimethyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole Traditional Name: 1-(4-benzoxy-2-bromo-5-methoxy-phenyl)-5,7-dimethyl-2,3,4,9-tetrahydro-1H-$b-carboline Formula: C27H27BrN2O2 MolecularWeight: 491.41948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C3=C(C(NCC3)C4=CC(=C(C=C4Br)OCC5=CC=CC=C5)OC)NC2=C1)C

Isomeric SMILES

CC1=CC(=C2C3=C(C(NCC3)C4=CC(=C(C=C4Br)OCC5=CC=CC=C5)OC)NC2=C1)C

InChI

InChI=1S/C27H27BrN2O2/c1-16-11-17(2)25-19-9-10-29-26(27(19)30-22(25)12-16)20-13-23(31-3)24(14-21(20)28)32-15-18-7-5-4-6-8-18/h4-8,11-14,26,29-30H,9-10,15H2,1-3H3