methyl 3-[2-(benzotriazol-1-yl)ethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[2-(benzotriazol-1-yl)ethanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[2-(benzotriazol-1-yl)acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-(1-benzotriazolyl)-1-oxoethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-(benzotriazol-1-yl)acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-(benzotriazol-1-yl)acetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C18H18N4O3/c1-25-18(24)11-15(13-7-3-2-4-8-13)19-17(23)12-22-16-10-6-5-9-14(16)20-21-22/h2-10,15H,11-12H2,1H3,(H,19,23)