[2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 2-(2,5-dimethylphenyl)carbonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(quinolin-5-ylamino)ethyl] 2-(2,5-dimethylphenyl)carbonylbenzoate Openeye Name: [2-oxo-2-(5-quinolylamino)ethyl] 2-(2,5-dimethylbenzoyl)benzoate CAS Name: 2-[(2,5-dimethylphenyl)-oxomethyl]benzoic acid [2-oxo-2-(5-quinolinylamino)ethyl] ester IUPAC Name: [2-oxo-2-(quinolin-5-ylamino)ethyl] 2-(2,5-dimethylbenzoyl)benzoate Traditional Name: 2-(2,5-dimethylbenzoyl)benzoic acid [2-keto-2-(5-quinolylamino)ethyl] ester Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(=O)C2=CC=CC=C2C(=O)OCC(=O)NC3=CC=CC4=C3C=CC=N4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)C2=CC=CC=C2C(=O)OCC(=O)NC3=CC=CC4=C3C=CC=N4

InChI

InChI=1S/C27H22N2O4/c1-17-12-13-18(2)22(15-17)26(31)19-7-3-4-8-20(19)27(32)33-16-25(30)29-24-11-5-10-23-21(24)9-6-14-28-23/h3-15H,16H2,1-2H3,(H,29,30)