4-chloranyl-3-[2-[4-(1H-imidazol-2-yl)phenyl]carbonyloxypropanoylamino]benzoic acid

Systemtic Name: 4-chloranyl-3-[2-[4-(1H-imidazol-2-yl)phenyl]carbonyloxypropanoylamino]benzoic acid Openeye Name: 4-chloro-3-[2-[4-(1H-imidazol-2-yl)benzoyl]oxypropanoylamino]benzoic acid CAS Name: 4-chloro-3-[[2-[[4-(1H-imidazol-2-yl)phenyl]-oxomethoxy]-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-chloro-3-[2-[4-(1H-imidazol-2-yl)benzoyl]oxypropanoylamino]benzoic acid Traditional Name: 4-chloro-3-[2-[4-(1H-imidazol-2-yl)benzoyl]oxypropanoylamino]benzoic acid Formula: C20H16ClN3O5 MolecularWeight: 413.81114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)OC(=O)C2=CC=C(C=C2)C3=NC=CN3

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)C(=O)O)Cl)OC(=O)C2=CC=C(C=C2)C3=NC=CN3

InChI

InChI=1S/C20H16ClN3O5/c1-11(18(25)24-16-10-14(19(26)27)6-7-15(16)21)29-20(28)13-4-2-12(3-5-13)17-22-8-9-23-17/h2-11H,1H3,(H,22,23)(H,24,25)(H,26,27)