3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-propylpiperazin-1-yl)carbonyl-3,4-dihydroisoquinolin-1-one

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-propylpiperazin-1-yl)carbonyl-3,4-dihydroisoquinolin-1-one Openeye Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-propylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1-one CAS Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-[oxo-(4-propyl-1-piperazinyl)methyl]-3,4-dihydroisoquinolin-1-one IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-propylpiperazine-1-carbonyl)-3,4-dihydroisoquinolin-1-one Traditional Name: 3-(3,4-dimethoxyphenyl)-2-methyl-4-(4-propylpiperazine-1-carbonyl)-3,4-dihydroisocarbostyril Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCCN1CCN(CC1)C(=O)C2C(N(C(=O)C3=CC=CC=C23)C)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C26H33N3O4/c1-5-12-28-13-15-29(16-14-28)26(31)23-19-8-6-7-9-20(19)25(30)27(2)24(23)18-10-11-21(32-3)22(17-18)33-4/h6-11,17,23-24H,5,12-16H2,1-4H3