methyl 2,4-dimethyl-5-(3-phenylpropylcarbamoyl)-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2,4-dimethyl-5-(3-phenylpropylcarbamoyl)-1H-pyrrole-3-carboxylate Openeye Name: methyl 2,4-dimethyl-5-(3-phenylpropylcarbamoyl)-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-(3-phenylpropylamino)methyl]-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-5-(3-phenylpropylcarbamoyl)-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(3-phenylpropylcarbamoyl)-1H-pyrrole-3-carboxylic acid methyl ester Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC)C)C(=O)NCCCC2=CC=CC=C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC)C)C(=O)NCCCC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O3/c1-12-15(18(22)23-3)13(2)20-16(12)17(21)19-11-7-10-14-8-5-4-6-9-14/h4-6,8-9,20H,7,10-11H2,1-3H3,(H,19,21)