4-(3,5-dimethylpiperidin-1-yl)carbonyl-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one

Systemtic Name: 4-(3,5-dimethylpiperidin-1-yl)carbonyl-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 4-(3,5-dimethylpiperidine-1-carbonyl)-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one CAS Name: 4-[(3,5-dimethyl-1-piperidinyl)-oxomethyl]-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-(3,5-dimethylpiperidine-1-carbonyl)-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 4-(3,5-dimethylpiperidine-1-carbonyl)-2,3-bis(4-methoxyphenyl)-3,4-dihydroisocarbostyril Formula: C31H34N2O4 MolecularWeight: 498.61266

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC)C

InChI

InChI=1S/C31H34N2O4/c1-20-17-21(2)19-32(18-20)31(35)28-26-7-5-6-8-27(26)30(34)33(23-11-15-25(37-4)16-12-23)29(28)22-9-13-24(36-3)14-10-22/h5-16,20-21,28-29H,17-19H2,1-4H3