(1-azanyl-1-oxidanylidene-propan-2-yl) 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 2-(5-chloranylthiophen-2-yl)quinoline-4-carboxylate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 2-(5-chloro-2-thienyl)quinoline-4-carboxylate CAS Name: 2-(5-chloro-2-thiophenyl)-4-quinolinecarboxylic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 2-(5-chlorothiophen-2-yl)quinoline-4-carboxylate Traditional Name: 2-(5-chloro-2-thienyl)cinchoninic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C17H13ClN2O3S MolecularWeight: 360.81472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(S3)Cl

Isomeric SMILES

CC(C(=O)N)OC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(S3)Cl

InChI

InChI=1S/C17H13ClN2O3S/c1-9(16(19)21)23-17(22)11-8-13(14-6-7-15(18)24-14)20-12-5-3-2-4-10(11)12/h2-9H,1H3,(H2,19,21)