O1-ethyl O4-[(2R)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxidanylidene-propan-2-yl] (E)-but-2-enedioate

Systemtic Name: O1-ethyl O4-[(2R)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxidanylidene-propan-2-yl] (E)-but-2-enedioate Openeye Name: O1-ethyl O4-[(1R)-1-methyl-2-[(2S)-2-methylindolin-1-yl]-2-oxo-ethyl] (E)-but-2-enedioate CAS Name: (E)-2-butenedioic acid O1-ethyl ester O4-[(2R)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxopropan-2-yl] ester IUPAC Name: 1-O-ethyl 4-O-[(2R)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxopropan-2-yl] (E)-but-2-enedioate Traditional Name: (E)-but-2-enedioic acid O1-ethyl ester O4-[(1R)-2-keto-1-methyl-2-[(2S)-2-methylindolin-1-yl]ethyl] ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(=O)OC(C)C(=O)N1C(CC2=CC=CC=C21)C

Isomeric SMILES

CCOC(=O)/C=C/C(=O)O[C@H](C)C(=O)N1[C@H](CC2=CC=CC=C21)C

InChI

InChI=1S/C18H21NO5/c1-4-23-16(20)9-10-17(21)24-13(3)18(22)19-12(2)11-14-7-5-6-8-15(14)19/h5-10,12-13H,4,11H2,1-3H3/b10-9+/t12-,13+/m0/s1