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

Systemtic Name: ethyl 10-(2,2-dimethylpropanoylamino)-7-methyl-4-oxidanylidene-pyrimido[2,1-a]isoquinoline-3-carboxylate Openeye Name: ethyl 10-(2,2-dimethylpropanoylamino)-7-methyl-4-oxo-pyrimido[2,1-a]isoquinoline-3-carboxylate CAS Name: 10-[(2,2-dimethyl-1-oxopropyl)amino]-7-methyl-4-oxo-3-pyrimido[2,1-a]isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 10-(2,2-dimethylpropanoylamino)-7-methyl-4-oxopyrimido[2,1-a]isoquinoline-3-carboxylate Traditional Name: 4-keto-7-methyl-10-(pivaloylamino)pyrimid[2,1-a]isoquinoline-3-carboxylic acid ethyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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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)C(=CN2C1=O)C

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4/c1-6-28-19(26)16-10-22-17-15-9-13(23-20(27)21(3,4)5)7-8-14(15)12(2)11-24(17)18(16)25/h7-11H,6H2,1-5H3,(H,23,27)