2-cyclopropyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-3-(3-methylphenyl)-3,4-dihydroisoquinolin-1-one

Systemtic Name: 2-cyclopropyl-4-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-3-(3-methylphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 2-cyclopropyl-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-3-(m-tolyl)-3,4-dihydroisoquinolin-1-one CAS Name: 2-cyclopropyl-4-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]-3-(3-methylphenyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-cyclopropyl-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-3-(3-methylphenyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 2-cyclopropyl-4-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-3-(m-tolyl)-3,4-dihydroisocarbostyril Formula: C31H33N3O3 MolecularWeight: 495.61202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)N5CCN(CC5)C6=CC=CC=C6OC

Isomeric SMILES

CC1=CC=CC(=C1)C2C(C3=CC=CC=C3C(=O)N2C4CC4)C(=O)N5CCN(CC5)C6=CC=CC=C6OC

InChI

InChI=1S/C31H33N3O3/c1-21-8-7-9-22(20-21)29-28(24-10-3-4-11-25(24)30(35)34(29)23-14-15-23)31(36)33-18-16-32(17-19-33)26-12-5-6-13-27(26)37-2/h3-13,20,23,28-29H,14-19H2,1-2H3