2-azanyl-4-(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)-1-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydroindole-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl)-1-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydroindole-3-carbonitrile Openeye Name: 2-amino-4-(5,5-dimethyl-3-oxo-cyclohexen-1-yl)-1-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydroindole-3-carbonitrile CAS Name: 2-amino-4-(5,5-dimethyl-3-oxo-1-cyclohexenyl)-1-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydroindole-3-carbonitrile IUPAC Name: 2-amino-4-(5,5-dimethyl-3-oxocyclohexen-1-yl)-1-[(4-methoxyphenyl)methyl]-4,5,6,7-tetrahydroindole-3-carbonitrile Traditional Name: 2-amino-4-(3-keto-5,5-dimethyl-cyclohexen-1-yl)-1-p-anisyl-4,5,6,7-tetrahydroindole-3-carbonitrile Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)C2CCCC3=C2C(=C(N3CC4=CC=C(C=C4)OC)N)C#N)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)C2CCCC3=C2C(=C(N3CC4=CC=C(C=C4)OC)N)C#N)C

InChI

InChI=1S/C25H29N3O2/c1-25(2)12-17(11-18(29)13-25)20-5-4-6-22-23(20)21(14-26)24(27)28(22)15-16-7-9-19(30-3)10-8-16/h7-11,20H,4-6,12-13,15,27H2,1-3H3