2-(1,4-dimethylpyrrol-2-yl)propanoyl 4-chloranylbenzoate

Systemtic Name: 2-(1,4-dimethylpyrrol-2-yl)propanoyl 4-chloranylbenzoate Openeye Name: 2-(1,4-dimethylpyrrol-2-yl)propanoyl 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [2-(1,4-dimethyl-2-pyrrolyl)-1-oxopropyl] ester IUPAC Name: 2-(1,4-dimethylpyrrol-2-yl)propanoyl 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid 2-(1,4-dimethylpyrrol-2-yl)propanoyl ester Formula: C16H16ClNO3 MolecularWeight: 305.75614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=C1)C(C)C(=O)OC(=O)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CN(C(=C1)C(C)C(=O)OC(=O)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C16H16ClNO3/c1-10-8-14(18(3)9-10)11(2)15(19)21-16(20)12-4-6-13(17)7-5-12/h4-9,11H,1-3H3