3-[3-(aminocarbamoyl)benzotriazol-5-yl]-3-(4-chlorophenyl)propanoic acid

Systemtic Name: 3-[3-(aminocarbamoyl)benzotriazol-5-yl]-3-(4-chlorophenyl)propanoic acid Openeye Name: 3-(4-chlorophenyl)-3-[3-(hydrazinecarbonyl)benzotriazol-5-yl]propanoic acid CAS Name: 3-(4-chlorophenyl)-3-[3-(hydrazinecarbonyl)-5-benzotriazolyl]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-3-[3-(hydrazinecarbonyl)benzotriazol-5-yl]propanoic acid Traditional Name: 3-(3-carbazoylbenzotriazol-5-yl)-3-(4-chlorophenyl)propionic acid Formula: C16H14ClN5O3 MolecularWeight: 359.76706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CC(=O)O)C2=CC3=C(C=C2)N=NN3C(=O)NN)Cl

Isomeric SMILES

C1=CC(=CC=C1C(CC(=O)O)C2=CC3=C(C=C2)N=NN3C(=O)NN)Cl

InChI

InChI=1S/C16H14ClN5O3/c17-11-4-1-9(2-5-11)12(8-15(23)24)10-3-6-13-14(7-10)22(21-20-13)16(25)19-18/h1-7,12H,8,18H2,(H,19,25)(H,23,24)