dimethyl (2S)-2-[2-(2-oxidanylidene-1,3-dihydroindol-3-yl)ethanoylamino]butanedioate

Systemtic Name: dimethyl (2S)-2-[2-(2-oxidanylidene-1,3-dihydroindol-3-yl)ethanoylamino]butanedioate Openeye Name: dimethyl (2S)-2-[[2-(2-oxoindolin-3-yl)acetyl]amino]butanedioate CAS Name: (2S)-2-[[1-oxo-2-(2-oxo-1,3-dihydroindol-3-yl)ethyl]amino]butanedioic acid dimethyl ester IUPAC Name: dimethyl (2S)-2-[[2-(2-oxo-1,3-dihydroindol-3-yl)acetyl]amino]butanedioate Traditional Name: (2S)-2-[[2-(2-ketoindolin-3-yl)acetyl]amino]succinic acid dimethyl ester Formula: C16H18N2O6 MolecularWeight: 335.317329

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)OC)NC(=O)CC1C2=CC=CC=C2NC1=O

Isomeric SMILES

COC(=O)C[C@@H](C(=O)OC)[15NH]C(=O)CC1C2=CC=CC=C2NC1=O

InChI

InChI=1S/C16H18N2O6/c1-23-14(20)8-12(16(22)24-2)17-13(19)7-10-9-5-3-4-6-11(9)18-15(10)21/h3-6,10,12H,7-8H2,1-2H3,(H,17,19)(H,18,21)/t10?,12-/m0/s1/i17+1