(phenylmethyl) 4-[propan-2-yl(prop-2-enylcarbamoyl)amino]-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 4-[propan-2-yl(prop-2-enylcarbamoyl)amino]-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-[allylcarbamoyl(isopropyl)amino]-1H-pyrrole-2-carboxylate CAS Name: 4-[[oxo-(prop-2-enylamino)methyl]-propan-2-ylamino]-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[propan-2-yl(prop-2-enylcarbamoyl)amino]-1H-pyrrole-2-carboxylate Traditional Name: 4-[allylcarbamoyl(isopropyl)amino]-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CNC(=C1)C(=O)OCC2=CC=CC=C2)C(=O)NCC=C

Isomeric SMILES

CC(C)N(C1=CNC(=C1)C(=O)OCC2=CC=CC=C2)C(=O)NCC=C

InChI

InChI=1S/C19H23N3O3/c1-4-10-20-19(24)22(14(2)3)16-11-17(21-12-16)18(23)25-13-15-8-6-5-7-9-15/h4-9,11-12,14,21H,1,10,13H2,2-3H3,(H,20,24)