propyl 2-[2,5-dimethyl-3-(phenylcarbonyl)pyrrol-1-yl]pentanoate

Systemtic Name: propyl 2-[2,5-dimethyl-3-(phenylcarbonyl)pyrrol-1-yl]pentanoate Openeye Name: propyl 2-(3-benzoyl-2,5-dimethyl-pyrrol-1-yl)pentanoate CAS Name: 2-(3-benzoyl-2,5-dimethyl-1-pyrrolyl)pentanoic acid propyl ester IUPAC Name: propyl 2-(3-benzoyl-2,5-dimethylpyrrol-1-yl)pentanoate Traditional Name: 2-(3-benzoyl-2,5-dimethyl-pyrrol-1-yl)valeric acid propyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)OCCC)N1C(=CC(=C1C)C(=O)C2=CC=CC=C2)C

Isomeric SMILES

CCCC(C(=O)OCCC)N1C(=CC(=C1C)C(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C21H27NO3/c1-5-10-19(21(24)25-13-6-2)22-15(3)14-18(16(22)4)20(23)17-11-8-7-9-12-17/h7-9,11-12,14,19H,5-6,10,13H2,1-4H3