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

Systemtic Name: methyl 3-[3-chloranyl-4-morpholin-4-yl-2,5-bis(oxidanylidene)pyrrol-1-yl]benzoate Openeye Name: methyl 3-(3-chloro-4-morpholino-2,5-dioxo-pyrrol-1-yl)benzoate CAS Name: 3-[3-chloro-4-(4-morpholinyl)-2,5-dioxo-1-pyrrolyl]benzoic acid methyl ester IUPAC Name: methyl 3-(3-chloro-4-morpholin-4-yl-2,5-dioxopyrrol-1-yl)benzoate Traditional Name: 3-(3-chloro-2,5-diketo-4-morpholino-3-pyrrolin-1-yl)benzoic acid methyl ester Formula: C16H15ClN2O5 MolecularWeight: 350.7537

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)N2C(=O)C(=C(C2=O)Cl)N3CCOCC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)N2C(=O)C(=C(C2=O)Cl)N3CCOCC3

InChI

InChI=1S/C16H15ClN2O5/c1-23-16(22)10-3-2-4-11(9-10)19-14(20)12(17)13(15(19)21)18-5-7-24-8-6-18/h2-4,9H,5-8H2,1H3