methyl 2-[(E)-[(E)-3-(4-dimethylaminophenyl)prop-2-enylidene]amino]-1-oxidanylidene-isoquinoline-4-carboxylate

Systemtic Name: methyl 2-[(E)-[(E)-3-(4-dimethylaminophenyl)prop-2-enylidene]amino]-1-oxidanylidene-isoquinoline-4-carboxylate Openeye Name: methyl 2-[(E)-[(E)-3-(4-dimethylaminophenyl)prop-2-enylidene]amino]-1-oxo-isoquinoline-4-carboxylate CAS Name: 2-[(E)-[(E)-3-(4-dimethylaminophenyl)prop-2-enylidene]amino]-1-oxo-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(E)-[(E)-3-(4-dimethylaminophenyl)prop-2-enylidene]amino]-1-oxoisoquinoline-4-carboxylate Traditional Name: 2-[(E)-[(E)-3-(4-dimethylaminophenyl)prop-2-enylidene]amino]-1-keto-isoquinoline-4-carboxylic acid methyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC=NN2C=C(C3=CC=CC=C3C2=O)C(=O)OC

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C=N/N2C=C(C3=CC=CC=C3C2=O)C(=O)OC

InChI

InChI=1S/C22H21N3O3/c1-24(2)17-12-10-16(11-13-17)7-6-14-23-25-15-20(22(27)28-3)18-8-4-5-9-19(18)21(25)26/h4-15H,1-3H3/b7-6+,23-14+