[3-butyl-7-methyl-6,8-bis(oxidanylidene)-2-(2-pyridin-2-ylethyl)isoquinolin-7-yl] propanoate

Systemtic Name: [3-butyl-7-methyl-6,8-bis(oxidanylidene)-2-(2-pyridin-2-ylethyl)isoquinolin-7-yl] propanoate Openeye Name: [3-butyl-7-methyl-6,8-dioxo-2-[2-(2-pyridyl)ethyl]-7-isoquinolyl] propanoate CAS Name: propanoic acid [3-butyl-7-methyl-6,8-dioxo-2-[2-(2-pyridinyl)ethyl]-7-isoquinolinyl] ester IUPAC Name: [3-butyl-7-methyl-6,8-dioxo-2-(2-pyridin-2-ylethyl)isoquinolin-7-yl] propanoate Traditional Name: propionic acid [3-butyl-6,8-diketo-7-methyl-2-[2-(2-pyridyl)ethyl]-7-isoquinolyl] ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC(=O)C(C(=O)C2=CN1CCC3=CC=CC=N3)(C)OC(=O)CC

Isomeric SMILES

CCCCC1=CC2=CC(=O)C(C(=O)C2=CN1CCC3=CC=CC=N3)(C)OC(=O)CC

InChI

InChI=1S/C24H28N2O4/c1-4-6-10-19-14-17-15-21(27)24(3,30-22(28)5-2)23(29)20(17)16-26(19)13-11-18-9-7-8-12-25-18/h7-9,12,14-16H,4-6,10-11,13H2,1-3H3