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

Systemtic Name: ethyl 10-(2,3-dimethylpentanoylamino)-7-methyl-4-oxidanylidene-pyrimido[2,1-a]isoquinoline-3-carboxylate Openeye Name: ethyl 10-(2,3-dimethylpentanoylamino)-7-methyl-4-oxo-pyrimido[2,1-a]isoquinoline-3-carboxylate CAS Name: 10-[(2,3-dimethyl-1-oxopentyl)amino]-7-methyl-4-oxo-3-pyrimido[2,1-a]isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 10-(2,3-dimethylpentanoylamino)-7-methyl-4-oxopyrimido[2,1-a]isoquinoline-3-carboxylate Traditional Name: 10-(2,3-dimethylpentanoylamino)-4-keto-7-methyl-pyrimid[2,1-a]isoquinoline-3-carboxylic acid ethyl ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)C(=O)NC1=CC2=C(C=C1)C(=CN3C2=NC=C(C3=O)C(=O)OCC)C

Isomeric SMILES

CCC(C)C(C)C(=O)NC1=CC2=C(C=C1)C(=CN3C2=NC=C(C3=O)C(=O)OCC)C

InChI

InChI=1S/C23H27N3O4/c1-6-13(3)15(5)21(27)25-16-8-9-17-14(4)12-26-20(18(17)10-16)24-11-19(22(26)28)23(29)30-7-2/h8-13,15H,6-7H2,1-5H3,(H,25,27)