4-[1-(hydroxymethyl)indol-3-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[1-(hydroxymethyl)indol-3-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[1-(hydroxymethyl)indol-3-yl]-4-oxo-butanoate CAS Name: 4-[1-(hydroxymethyl)-3-indolyl]-4-oxobutanoate IUPAC Name: 4-[1-(hydroxymethyl)indol-3-yl]-4-oxobutanoate Traditional Name: 4-keto-4-(1-methylolindol-3-yl)butyrate Formula: C13H12NO4- MolecularWeight: 246.23868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CO)C(=O)CCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CO)C(=O)CCC(=O)[O-]

InChI

InChI=1S/C13H13NO4/c15-8-14-7-10(12(16)5-6-13(17)18)9-3-1-2-4-11(9)14/h1-4,7,15H,5-6,8H2,(H,17,18)/p-1