ethyl (E)-3-[2-(butylamino)-6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate

Systemtic Name: ethyl (E)-3-[2-(butylamino)-6-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate Openeye Name: ethyl (E)-3-[2-(butylamino)-6-methyl-4-oxo-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate CAS Name: (E)-3-[2-(butylamino)-6-methyl-4-oxo-3-pyrido[1,2-a]pyrimidinyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[2-(butylamino)-6-methyl-4-oxopyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate Traditional Name: (E)-3-[2-(butylamino)-4-keto-6-methyl-pyrido[1,2-a]pyrimidin-3-yl]acrylic acid ethyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=O)N2C(=CC=CC2=N1)C)C=CC(=O)OCC

Isomeric SMILES

CCCCNC1=C(C(=O)N2C(=CC=CC2=N1)C)/C=C/C(=O)OCC

InChI

InChI=1S/C18H23N3O3/c1-4-6-12-19-17-14(10-11-16(22)24-5-2)18(23)21-13(3)8-7-9-15(21)20-17/h7-11,19H,4-6,12H2,1-3H3/b11-10+