3-[(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl)-methyl-amino]-1-(4-methoxy-3-oxidanyl-phenyl)cyclohexane-1-carbonitrile

Systemtic Name: 3-[(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl)-methyl-amino]-1-(4-methoxy-3-oxidanyl-phenyl)cyclohexane-1-carbonitrile Openeye Name: 3-[(5,6-dimethoxyindan-2-yl)-methyl-amino]-1-(3-hydroxy-4-methoxy-phenyl)cyclohexanecarbonitrile CAS Name: 3-[(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl)-methylamino]-1-(3-hydroxy-4-methoxyphenyl)-1-cyclohexanecarbonitrile IUPAC Name: 3-[(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl)-methylamino]-1-(3-hydroxy-4-methoxyphenyl)cyclohexane-1-carbonitrile Traditional Name: 3-[(5,6-dimethoxyindan-2-yl)-methyl-amino]-1-(3-hydroxy-4-methoxy-phenyl)cyclohexanecarbonitrile Formula: C26H32N2O4 MolecularWeight: 436.54328

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCC(C1)(C#N)C2=CC(=C(C=C2)OC)O)C3CC4=CC(=C(C=C4C3)OC)OC

Isomeric SMILES

CN(C1CCCC(C1)(C#N)C2=CC(=C(C=C2)OC)O)C3CC4=CC(=C(C=C4C3)OC)OC

InChI

InChI=1S/C26H32N2O4/c1-28(21-10-17-12-24(31-3)25(32-4)13-18(17)11-21)20-6-5-9-26(15-20,16-27)19-7-8-23(30-2)22(29)14-19/h7-8,12-14,20-21,29H,5-6,9-11,15H2,1-4H3