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

Systemtic Name: methyl 3,5-dimethyl-4-[2-[(4-methylphenyl)carbonyl-prop-2-enyl-amino]ethanoyl]-1H-pyrrole-2-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC=C)CC(=O)C2=C(NC(=C2C)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC=C)CC(=O)C2=C(NC(=C2C)C(=O)OC)C

InChI

InChI=1S/C21H24N2O4/c1-6-11-23(20(25)16-9-7-13(2)8-10-16)12-17(24)18-14(3)19(21(26)27-5)22-15(18)4/h6-10,22H,1,11-12H2,2-5H3