4-oxidanylidene-4-[1-(phenylmethyl)-2,3-dihydroindol-5-yl]butanoate

Systemtic Name: 4-oxidanylidene-4-[1-(phenylmethyl)-2,3-dihydroindol-5-yl]butanoate Openeye Name: 4-(1-benzylindolin-5-yl)-4-oxo-butanoate CAS Name: 4-oxo-4-[1-(phenylmethyl)-2,3-dihydroindol-5-yl]butanoate IUPAC Name: 4-(1-benzyl-2,3-dihydroindol-5-yl)-4-oxobutanoate Traditional Name: 4-(1-benzylindolin-5-yl)-4-keto-butyrate Formula: C19H18NO3- MolecularWeight: 308.35112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)C(=O)CCC(=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)C(=O)CCC(=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H19NO3/c21-18(8-9-19(22)23)16-6-7-17-15(12-16)10-11-20(17)13-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,22,23)/p-1