4-(4-cyclopentylpiperazin-1-yl)carbonyl-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-1-one

Systemtic Name: 4-(4-cyclopentylpiperazin-1-yl)carbonyl-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-1-one Openeye Name: 4-(4-cyclopentylpiperazine-1-carbonyl)-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-1-one CAS Name: 4-[(4-cyclopentyl-1-piperazinyl)-oxomethyl]-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-1-one IUPAC Name: 4-(4-cyclopentylpiperazine-1-carbonyl)-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 4-(4-cyclopentylpiperazine-1-carbonyl)-2-propyl-3-(3,4,5-trimethoxyphenyl)-3,4-dihydroisocarbostyril Formula: C31H41N3O5 MolecularWeight: 535.67434

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)C4CCCC4)C5=CC(=C(C(=C5)OC)OC)OC

Isomeric SMILES

CCCN1C(C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)C4CCCC4)C5=CC(=C(C(=C5)OC)OC)OC

InChI

InChI=1S/C31H41N3O5/c1-5-14-34-28(21-19-25(37-2)29(39-4)26(20-21)38-3)27(23-12-8-9-13-24(23)30(34)35)31(36)33-17-15-32(16-18-33)22-10-6-7-11-22/h8-9,12-13,19-20,22,27-28H,5-7,10-11,14-18H2,1-4H3