methyl 3-[3-chloranyl-2,5-bis(oxidanylidene)-4-piperidin-1-yl-pyrrol-1-yl]benzoate

Systemtic Name: methyl 3-[3-chloranyl-2,5-bis(oxidanylidene)-4-piperidin-1-yl-pyrrol-1-yl]benzoate Openeye Name: methyl 3-[3-chloro-2,5-dioxo-4-(1-piperidyl)pyrrol-1-yl]benzoate CAS Name: 3-[3-chloro-2,5-dioxo-4-(1-piperidinyl)-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 3-(3-chloro-2,5-dioxo-4-piperidin-1-ylpyrrol-1-yl)benzoate Traditional Name: 3-(3-chloro-2,5-diketo-4-piperidino-3-pyrrolin-1-yl)benzoic acid methyl ester Formula: C17H17ClN2O4 MolecularWeight: 348.78088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)N2C(=O)C(=C(C2=O)Cl)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)N2C(=O)C(=C(C2=O)Cl)N3CCCCC3

InChI

InChI=1S/C17H17ClN2O4/c1-24-17(23)11-6-5-7-12(10-11)20-15(21)13(18)14(16(20)22)19-8-3-2-4-9-19/h5-7,10H,2-4,8-9H2,1H3