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

Systemtic Name: (phenylmethyl) 4-[ethylcarbamoyl(prop-2-enyl)amino]-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-[allyl(ethylcarbamoyl)amino]-1H-pyrrole-2-carboxylate CAS Name: 4-[ethylcarbamoyl(prop-2-enyl)amino]-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[ethylcarbamoyl(prop-2-enyl)amino]-1H-pyrrole-2-carboxylate Traditional Name: 4-[allyl(ethylcarbamoyl)amino]-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C18H21N3O3 MolecularWeight: 327.37764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O3/c1-3-10-21(18(23)19-4-2)15-11-16(20-12-15)17(22)24-13-14-8-6-5-7-9-14/h3,5-9,11-12,20H,1,4,10,13H2,2H3,(H,19,23)