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

Systemtic Name: 2-cyclopropyl-4-[4-(2-methoxyethyl)piperazin-1-yl]carbonyl-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 2-cyclopropyl-4-[4-(2-methoxyethyl)piperazine-1-carbonyl]-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1-one CAS Name: 2-cyclopropyl-4-[[4-(2-methoxyethyl)-1-piperazinyl]-oxomethyl]-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 2-cyclopropyl-4-[4-(2-methoxyethyl)piperazine-1-carbonyl]-3-(3-methoxyphenyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 2-cyclopropyl-4-[4-(2-methoxyethyl)piperazine-1-carbonyl]-3-(3-methoxyphenyl)-3,4-dihydroisocarbostyril Formula: C27H33N3O4 MolecularWeight: 463.56862

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C4CC4)C5=CC(=CC=C5)OC

Isomeric SMILES

COCCN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C4CC4)C5=CC(=CC=C5)OC

InChI

InChI=1S/C27H33N3O4/c1-33-17-16-28-12-14-29(15-13-28)27(32)24-22-8-3-4-9-23(22)26(31)30(20-10-11-20)25(24)19-6-5-7-21(18-19)34-2/h3-9,18,20,24-25H,10-17H2,1-2H3