[(E)-[9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-ylidene]amino] quinoline-2-carboxylate

Systemtic Name: [(E)-[9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-ylidene]amino] quinoline-2-carboxylate Openeye Name: [(E)-[9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-ylidene]amino] quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid [(E)-[9-methyl-3-[(2-methyl-1-imidazolyl)methyl]-2,3-dihydro-1H-carbazol-4-ylidene]amino] ester IUPAC Name: [(E)-[9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-ylidene]amino] quinoline-2-carboxylate Traditional Name: quinaldic acid [(E)-[9-methyl-3-[(2-methylimidazol-1-yl)methyl]-2,3-dihydro-1H-carbazol-4-ylidene]amino] ester Formula: C28H25N5O2 MolecularWeight: 463.5304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1CC2CCC3=C(C2=NOC(=O)C4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6N3C

Isomeric SMILES

CC1=NC=CN1CC\2CCC3=C(/C2=N/OC(=O)C4=NC5=CC=CC=C5C=C4)C6=CC=CC=C6N3C

InChI

InChI=1S/C28H25N5O2/c1-18-29-15-16-33(18)17-20-12-14-25-26(21-8-4-6-10-24(21)32(25)2)27(20)31-35-28(34)23-13-11-19-7-3-5-9-22(19)30-23/h3-11,13,15-16,20H,12,14,17H2,1-2H3/b31-27+