methyl (2S)-2-[(1-ethylbenzotriazol-5-yl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[(1-ethylbenzotriazol-5-yl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[(1-ethylbenzotriazole-5-carbonyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(1-ethyl-5-benzotriazolyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1-ethylbenzotriazole-5-carbonyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(1-ethylbenzotriazole-5-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C19H20N4O3 MolecularWeight: 352.3871

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)NC(CC3=CC=CC=C3)C(=O)OC)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)OC)N=N1

InChI

InChI=1S/C19H20N4O3/c1-3-23-17-10-9-14(12-15(17)21-22-23)18(24)20-16(19(25)26-2)11-13-7-5-4-6-8-13/h4-10,12,16H,3,11H2,1-2H3,(H,20,24)/t16-/m0/s1