(E)-4-methoxy-4-oxidanylidene-but-2-enoic acid; 10-methyl-7H-pyrido[1,2-a]indol-6-one

Systemtic Name: (E)-4-methoxy-4-oxidanylidene-but-2-enoic acid; 10-methyl-7H-pyrido[1,2-a]indol-6-one Openeye Name: (E)-4-methoxy-4-oxo-but-2-enoic acid; 10-methyl-7H-pyrido[1,2-a]indol-6-one CAS Name: (E)-4-methoxy-4-oxo-2-butenoic acid; 10-methyl-7H-pyrido[1,2-a]indol-6-one IUPAC Name: (E)-4-methoxy-4-oxobut-2-enoic acid; 10-methyl-7H-pyrido[1,2-a]indol-6-one Traditional Name: (E)-4-keto-4-methoxy-but-2-enoic acid; 10-methyl-7H-pyrid[1,2-a]indol-6-one Formula: C18H17NO5 MolecularWeight: 327.33128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CCC(=O)N2C3=CC=CC=C13.COC(=O)C=CC(=O)O

Isomeric SMILES

CC1=C2C=CCC(=O)N2C3=CC=CC=C13.COC(=O)/C=C/C(=O)O

InChI

InChI=1S/C13H11NO.C5H6O4/c1-9-10-5-2-3-6-12(10)14-11(9)7-4-8-13(14)15;1-9-5(8)3-2-4(6)7/h2-7H,8H2,1H3;2-3H,1H3,(H,6,7)/b;3-2+