(1-azanyl-1-oxidanylidene-propan-2-yl) 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylate CAS Name: 2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolecarboxylic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 2,5-dimethyl-1-(4-methylphenyl)pyrrole-3-carboxylate Traditional Name: 2,5-dimethyl-1-(p-tolyl)pyrrole-3-carboxylic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)OC(C)C(=O)N)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=C2C)C(=O)OC(C)C(=O)N)C

InChI

InChI=1S/C17H20N2O3/c1-10-5-7-14(8-6-10)19-11(2)9-15(12(19)3)17(21)22-13(4)16(18)20/h5-9,13H,1-4H3,(H2,18,20)