phenyl 2-[benzotriazol-1-yl(phenylmethoxycarbonyl)amino]ethanoate

Systemtic Name: phenyl 2-[benzotriazol-1-yl(phenylmethoxycarbonyl)amino]ethanoate Openeye Name: phenyl 2-[benzotriazol-1-yl(benzyloxycarbonyl)amino]acetate CAS Name: 2-[1-benzotriazolyl(phenylmethoxycarbonyl)amino]acetic acid phenyl ester IUPAC Name: phenyl 2-[benzotriazol-1-yl(phenylmethoxycarbonyl)amino]acetate Traditional Name: 2-[benzotriazol-1-yl(carbobenzoxy)amino]acetic acid phenyl ester Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N(CC(=O)OC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N(CC(=O)OC2=CC=CC=C2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C22H18N4O4/c27-21(30-18-11-5-2-6-12-18)15-25(22(28)29-16-17-9-3-1-4-10-17)26-20-14-8-7-13-19(20)23-24-26/h1-14H,15-16H2