methyl 3-(2H-benzotriazol-5-ylcarbonylamino)-3-(4-methylphenyl)propanoate

Systemtic Name: methyl 3-(2H-benzotriazol-5-ylcarbonylamino)-3-(4-methylphenyl)propanoate Openeye Name: methyl 3-(2H-benzotriazole-5-carbonylamino)-3-(p-tolyl)propanoate CAS Name: 3-[[2H-benzotriazol-5-yl(oxo)methyl]amino]-3-(4-methylphenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(2H-benzotriazole-5-carbonylamino)-3-(4-methylphenyl)propanoate Traditional Name: 3-(2H-benzotriazole-5-carbonylamino)-3-(p-tolyl)propionic acid methyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=CC3=NNN=C3C=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=CC3=NNN=C3C=C2

InChI

InChI=1S/C18H18N4O3/c1-11-3-5-12(6-4-11)15(10-17(23)25-2)19-18(24)13-7-8-14-16(9-13)21-22-20-14/h3-9,15H,10H2,1-2H3,(H,19,24)(H,20,21,22)