2-[2-[[4-chloranyl-2-ethanoyl-5-(methylamino)phenyl]amino]ethanoylamino]benzoic acid

Systemtic Name: 2-[2-[[4-chloranyl-2-ethanoyl-5-(methylamino)phenyl]amino]ethanoylamino]benzoic acid Openeye Name: 2-[[2-[2-acetyl-4-chloro-5-(methylamino)anilino]acetyl]amino]benzoic acid CAS Name: 2-[[2-[2-acetyl-4-chloro-5-(methylamino)anilino]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-[2-acetyl-4-chloro-5-(methylamino)anilino]acetyl]amino]benzoic acid Traditional Name: 2-[[2-[2-acetyl-4-chloro-5-(methylamino)anilino]acetyl]amino]benzoic acid Formula: C18H18ClN3O4 MolecularWeight: 375.80622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1NCC(=O)NC2=CC=CC=C2C(=O)O)NC)Cl

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1NCC(=O)NC2=CC=CC=C2C(=O)O)NC)Cl

InChI

InChI=1S/C18H18ClN3O4/c1-10(23)12-7-13(19)16(20-2)8-15(12)21-9-17(24)22-14-6-4-3-5-11(14)18(25)26/h3-8,20-21H,9H2,1-2H3,(H,22,24)(H,25,26)