ethyl 7-methyl-10-(2-methylpropanoylamino)-4-oxidanylidene-pyrimido[2,1-a]isoquinoline-3-carboxylate

Systemtic Name: ethyl 7-methyl-10-(2-methylpropanoylamino)-4-oxidanylidene-pyrimido[2,1-a]isoquinoline-3-carboxylate Openeye Name: ethyl 7-methyl-10-(2-methylpropanoylamino)-4-oxo-pyrimido[2,1-a]isoquinoline-3-carboxylate CAS Name: 7-methyl-10-[(2-methyl-1-oxopropyl)amino]-4-oxo-3-pyrimido[2,1-a]isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-methyl-10-(2-methylpropanoylamino)-4-oxopyrimido[2,1-a]isoquinoline-3-carboxylate Traditional Name: 10-(isobutyrylamino)-4-keto-7-methyl-pyrimid[2,1-a]isoquinoline-3-carboxylic acid ethyl ester Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C3=C(C=CC(=C3)NC(=O)C(C)C)C(=CN2C1=O)C

Isomeric SMILES

CCOC(=O)C1=CN=C2C3=C(C=CC(=C3)NC(=O)C(C)C)C(=CN2C1=O)C

InChI

InChI=1S/C20H21N3O4/c1-5-27-20(26)16-9-21-17-15-8-13(22-18(24)11(2)3)6-7-14(15)12(4)10-23(17)19(16)25/h6-11H,5H2,1-4H3,(H,22,24)