ethyl 4-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)benzoate

Systemtic Name: ethyl 4-(3-methanoyl-2,5-dimethyl-pyrrol-1-yl)benzoate Openeye Name: ethyl 4-(3-formyl-2,5-dimethyl-pyrrol-1-yl)benzoate CAS Name: 4-(3-formyl-2,5-dimethyl-1-pyrrolyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(3-formyl-2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(3-formyl-2,5-dimethyl-pyrrol-1-yl)benzoic acid ethyl ester Formula: C16H17NO3 MolecularWeight: 271.31108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=O)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)C=O)C

InChI

InChI=1S/C16H17NO3/c1-4-20-16(19)13-5-7-15(8-6-13)17-11(2)9-14(10-18)12(17)3/h5-10H,4H2,1-3H3