methyl (3S)-3-phenyl-3-[[4-(1,2,4-triazol-1-yl)phenyl]carbonylamino]propanoate

Systemtic Name: methyl (3S)-3-phenyl-3-[[4-(1,2,4-triazol-1-yl)phenyl]carbonylamino]propanoate Openeye Name: methyl (3S)-3-phenyl-3-[[4-(1,2,4-triazol-1-yl)benzoyl]amino]propanoate CAS Name: (3S)-3-[[oxo-[4-(1,2,4-triazol-1-yl)phenyl]methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-phenyl-3-[[4-(1,2,4-triazol-1-yl)benzoyl]amino]propanoate Traditional Name: (3S)-3-phenyl-3-[[4-(1,2,4-triazol-1-yl)benzoyl]amino]propionic acid methyl ester Formula: C19H18N4O3 MolecularWeight: 350.37122

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

COC(=O)C[C@@H](C1=CC=CC=C1)NC(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C19H18N4O3/c1-26-18(24)11-17(14-5-3-2-4-6-14)22-19(25)15-7-9-16(10-8-15)23-13-20-12-21-23/h2-10,12-13,17H,11H2,1H3,(H,22,25)/t17-/m0/s1