(1-azanyl-1-oxidanylidene-propan-2-yl) 4-(2,5-dimethylpyrrol-1-yl)benzoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 4-(2,5-dimethylpyrrol-1-yl)benzoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 4-(2,5-dimethylpyrrol-1-yl)benzoate CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 4-(2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzoic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C16H18N2O3 MolecularWeight: 286.32572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OC(C)C(=O)N)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OC(C)C(=O)N)C

InChI

InChI=1S/C16H18N2O3/c1-10-4-5-11(2)18(10)14-8-6-13(7-9-14)16(20)21-12(3)15(17)19/h4-9,12H,1-3H3,(H2,17,19)