methyl 4-[1-(cyclohexylmethyl)pyrrol-2-yl]-2,4-bis(oxidanylidene)butanoate

Systemtic Name: methyl 4-[1-(cyclohexylmethyl)pyrrol-2-yl]-2,4-bis(oxidanylidene)butanoate Openeye Name: methyl 4-[1-(cyclohexylmethyl)pyrrol-2-yl]-2,4-dioxo-butanoate CAS Name: 4-[1-(cyclohexylmethyl)-2-pyrrolyl]-2,4-dioxobutanoic acid methyl ester IUPAC Name: methyl 4-[1-(cyclohexylmethyl)pyrrol-2-yl]-2,4-dioxobutanoate Traditional Name: 4-[1-(cyclohexylmethyl)pyrrol-2-yl]-2,4-diketo-butyric acid methyl ester Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=O)CC(=O)C1=CC=CN1CC2CCCCC2

Isomeric SMILES

COC(=O)C(=O)CC(=O)C1=CC=CN1CC2CCCCC2

InChI

InChI=1S/C16H21NO4/c1-21-16(20)15(19)10-14(18)13-8-5-9-17(13)11-12-6-3-2-4-7-12/h5,8-9,12H,2-4,6-7,10-11H2,1H3