2-cyclohexyl-3-(4-methoxyphenyl)-4-piperidin-1-ylcarbonyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-cyclohexyl-3-(4-methoxyphenyl)-4-piperidin-1-ylcarbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 2-cyclohexyl-3-(4-methoxyphenyl)-4-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one CAS Name: 2-cyclohexyl-3-(4-methoxyphenyl)-4-[oxo(1-piperidinyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-cyclohexyl-3-(4-methoxyphenyl)-4-(piperidine-1-carbonyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 2-cyclohexyl-3-(4-methoxyphenyl)-4-(piperidine-1-carbonyl)-3,4-dihydroisocarbostyril Formula: C28H34N2O3 MolecularWeight: 446.58116

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2C4CCCCC4)C(=O)N5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C2C(C3=CC=CC=C3C(=O)N2C4CCCCC4)C(=O)N5CCCCC5

InChI

InChI=1S/C28H34N2O3/c1-33-22-16-14-20(15-17-22)26-25(28(32)29-18-8-3-9-19-29)23-12-6-7-13-24(23)27(31)30(26)21-10-4-2-5-11-21/h6-7,12-17,21,25-26H,2-5,8-11,18-19H2,1H3