(2-benzamido-2-oxidanylidene-ethyl) (E)-3-[1-(phenylmethyl)-1,2,3-triazol-4-yl]prop-2-enoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) (E)-3-[1-(phenylmethyl)-1,2,3-triazol-4-yl]prop-2-enoate Openeye Name: (2-benzamido-2-oxo-ethyl) (E)-3-(1-benzyltriazol-4-yl)prop-2-enoate CAS Name: (E)-3-[1-(phenylmethyl)-4-triazolyl]-2-propenoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) (E)-3-(1-benzyltriazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1-benzyltriazol-4-yl)acrylic acid (2-benzamido-2-keto-ethyl) ester Formula: C21H18N4O4 MolecularWeight: 390.39202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(N=N2)C=CC(=O)OCC(=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(N=N2)/C=C/C(=O)OCC(=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H18N4O4/c26-19(22-21(28)17-9-5-2-6-10-17)15-29-20(27)12-11-18-14-25(24-23-18)13-16-7-3-1-4-8-16/h1-12,14H,13,15H2,(H,22,26,28)/b12-11+