2-[[5-(butanoylamino)-2-chloranyl-phenyl]carbamoyl]benzoic acid

Systemtic Name: 2-[[5-(butanoylamino)-2-chloranyl-phenyl]carbamoyl]benzoic acid Openeye Name: 2-[[5-(butanoylamino)-2-chloro-phenyl]carbamoyl]benzoic acid CAS Name: 2-[[2-chloro-5-(1-oxobutylamino)anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[[5-(butanoylamino)-2-chlorophenyl]carbamoyl]benzoic acid Traditional Name: 2-[(5-butyramido-2-chloro-phenyl)carbamoyl]benzoic acid Formula: C18H17ClN2O4 MolecularWeight: 360.79158

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H17ClN2O4/c1-2-5-16(22)20-11-8-9-14(19)15(10-11)21-17(23)12-6-3-4-7-13(12)18(24)25/h3-4,6-10H,2,5H2,1H3,(H,20,22)(H,21,23)(H,24,25)