[2-[(2-azanyl-2-oxidanylidene-ethyl)amino]-2-oxidanylidene-ethyl] 6-methoxy-2-phenyl-quinoline-4-carboxylate

Systemtic Name: [2-[(2-azanyl-2-oxidanylidene-ethyl)amino]-2-oxidanylidene-ethyl] 6-methoxy-2-phenyl-quinoline-4-carboxylate Openeye Name: [2-[(2-amino-2-oxo-ethyl)amino]-2-oxo-ethyl] 6-methoxy-2-phenyl-quinoline-4-carboxylate CAS Name: 6-methoxy-2-phenyl-4-quinolinecarboxylic acid [2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-amino-2-oxoethyl)amino]-2-oxoethyl] 6-methoxy-2-phenylquinoline-4-carboxylate Traditional Name: 6-methoxy-2-phenyl-cinchoninic acid [2-[(2-amino-2-keto-ethyl)amino]-2-keto-ethyl] ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)NCC(=O)N)C3=CC=CC=C3

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(C=C2C(=O)OCC(=O)NCC(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C21H19N3O5/c1-28-14-7-8-17-15(9-14)16(10-18(24-17)13-5-3-2-4-6-13)21(27)29-12-20(26)23-11-19(22)25/h2-10H,11-12H2,1H3,(H2,22,25)(H,23,26)