ethyl 3,5-dimethyl-4-[2-[(4-methylphenyl)carbonyl-prop-2-enyl-amino]ethanoyl]-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 3,5-dimethyl-4-[2-[(4-methylphenyl)carbonyl-prop-2-enyl-amino]ethanoyl]-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[allyl-(4-methylbenzoyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 3,5-dimethyl-4-[2-[[(4-methylphenyl)-oxomethyl]-prop-2-enylamino]-1-oxoethyl]-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3,5-dimethyl-4-[2-[(4-methylbenzoyl)-prop-2-enylamino]acetyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-[2-[allyl(p-toluoyl)amino]acetyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C22H26N2O4 MolecularWeight: 382.45284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN(CC=C)C(=O)C2=CC=C(C=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)C(=O)CN(CC=C)C(=O)C2=CC=C(C=C2)C)C

InChI

InChI=1S/C22H26N2O4/c1-6-12-24(21(26)17-10-8-14(3)9-11-17)13-18(25)19-15(4)20(23-16(19)5)22(27)28-7-2/h6,8-11,23H,1,7,12-13H2,2-5H3