methyl 4-[2-(1-methanoyl-5-oxidanyl-indol-3-yl)ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[2-(1-methanoyl-5-oxidanyl-indol-3-yl)ethylamino]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[2-(1-formyl-5-hydroxy-indol-3-yl)ethylamino]-4-oxo-butanoate CAS Name: 4-[2-(1-formyl-5-hydroxy-3-indolyl)ethylamino]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[2-(1-formyl-5-hydroxyindol-3-yl)ethylamino]-4-oxobutanoate Traditional Name: 4-[2-(1-formyl-5-hydroxy-indol-3-yl)ethylamino]-4-keto-butyric acid methyl ester Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)NCCC1=CN(C2=C1C=C(C=C2)O)C=O

Isomeric SMILES

COC(=O)CCC(=O)NCCC1=CN(C2=C1C=C(C=C2)O)C=O

InChI

InChI=1S/C16H18N2O5/c1-23-16(22)5-4-15(21)17-7-6-11-9-18(10-19)14-3-2-12(20)8-13(11)14/h2-3,8-10,20H,4-7H2,1H3,(H,17,21)