methyl 2-butyl-1,3-bis(oxidanylidene)-4H-isoquinoline-4-carboxylate

Systemtic Name: methyl 2-butyl-1,3-bis(oxidanylidene)-4H-isoquinoline-4-carboxylate Openeye Name: methyl 2-butyl-1,3-dioxo-4H-isoquinoline-4-carboxylate CAS Name: 2-butyl-1,3-dioxo-4H-isoquinoline-4-carboxylic acid methyl ester IUPAC Name: methyl 2-butyl-1,3-dioxo-4H-isoquinoline-4-carboxylate Traditional Name: 2-butyl-1,3-diketo-4H-isoquinoline-4-carboxylic acid methyl ester Formula: C15H17NO4 MolecularWeight: 275.29978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(C2=CC=CC=C2C1=O)C(=O)OC

Isomeric SMILES

CCCCN1C(=O)C(C2=CC=CC=C2C1=O)C(=O)OC

InChI

InChI=1S/C15H17NO4/c1-3-4-9-16-13(17)11-8-6-5-7-10(11)12(14(16)18)15(19)20-2/h5-8,12H,3-4,9H2,1-2H3