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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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