3-[(E)-3-[(4-aminophenyl)amino]but-2-enoyl]-1-methyl-4-oxidanylidene-quinolin-2-olate

Systemtic Name: 3-[(E)-3-[(4-aminophenyl)amino]but-2-enoyl]-1-methyl-4-oxidanylidene-quinolin-2-olate Openeye Name: 3-[(E)-3-(4-aminoanilino)but-2-enoyl]-1-methyl-4-oxo-quinolin-2-olate CAS Name: 3-[(E)-3-(4-aminoanilino)-1-oxobut-2-enyl]-1-methyl-4-oxo-2-quinolinolate IUPAC Name: 3-[(E)-3-(4-aminoanilino)but-2-enoyl]-1-methyl-4-oxoquinolin-2-olate Traditional Name: 3-[(E)-3-(4-aminoanilino)but-2-enoyl]-4-keto-1-methyl-quinolin-2-olate Formula: C20H18N3O3- MolecularWeight: 348.37522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)C1=C(N(C2=CC=CC=C2C1=O)C)[O-])NC3=CC=C(C=C3)N

Isomeric SMILES

C/C(=C\C(=O)C1=C(N(C2=CC=CC=C2C1=O)C)[O-])/NC3=CC=C(C=C3)N

InChI

InChI=1S/C20H19N3O3/c1-12(22-14-9-7-13(21)8-10-14)11-17(24)18-19(25)15-5-3-4-6-16(15)23(2)20(18)26/h3-11,22,26H,21H2,1-2H3/p-1/b12-11+