(phenylmethyl) 4-[phenylcarbamoyl(prop-2-enyl)amino]-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 4-[phenylcarbamoyl(prop-2-enyl)amino]-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-[allyl(phenylcarbamoyl)amino]-1H-pyrrole-2-carboxylate CAS Name: 4-[[anilino(oxo)methyl]-prop-2-enylamino]-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[phenylcarbamoyl(prop-2-enyl)amino]-1H-pyrrole-2-carboxylate Traditional Name: 4-[allyl(phenylcarbamoyl)amino]-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1=CNC(=C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C=CCN(C1=CNC(=C1)C(=O)OCC2=CC=CC=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O3/c1-2-13-25(22(27)24-18-11-7-4-8-12-18)19-14-20(23-15-19)21(26)28-16-17-9-5-3-6-10-17/h2-12,14-15,23H,1,13,16H2,(H,24,27)