2-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-8-chloranyl-5-methoxy-quinoline-3-carboxylic acid

Systemtic Name: 2-[(1-azanyl-2,3-dimethyl-1-oxidanylidene-butan-2-yl)carbamoyl]-8-chloranyl-5-methoxy-quinoline-3-carboxylic acid Openeye Name: 2-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-8-chloro-5-methoxy-quinoline-3-carboxylic acid CAS Name: 2-[[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)amino]-oxomethyl]-8-chloro-5-methoxy-3-quinolinecarboxylic acid IUPAC Name: 2-[(1-amino-2,3-dimethyl-1-oxobutan-2-yl)carbamoyl]-8-chloro-5-methoxyquinoline-3-carboxylic acid Traditional Name: 2-[(1-carbamoyl-1,2-dimethyl-propyl)carbamoyl]-8-chloro-5-methoxy-quinoline-3-carboxylic acid Formula: C18H20ClN3O5 MolecularWeight: 393.8215

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C(=O)N)NC(=O)C1=NC2=C(C=CC(=C2C=C1C(=O)O)OC)Cl

Isomeric SMILES

CC(C)C(C)(C(=O)N)NC(=O)C1=NC2=C(C=CC(=C2C=C1C(=O)O)OC)Cl

InChI

InChI=1S/C18H20ClN3O5/c1-8(2)18(3,17(20)26)22-15(23)14-10(16(24)25)7-9-12(27-4)6-5-11(19)13(9)21-14/h5-8H,1-4H3,(H2,20,26)(H,22,23)(H,24,25)