3-[(3S)-3-(1H-indol-3-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]-4-methyl-benzoate

Systemtic Name: 3-[(3S)-3-(1H-indol-3-yl)-2,5-bis(oxidanylidene)pyrrolidin-1-yl]-4-methyl-benzoate Openeye Name: 3-[(3S)-3-(1H-indol-3-yl)-2,5-dioxo-pyrrolidin-1-yl]-4-methyl-benzoate CAS Name: 3-[(3S)-3-(1H-indol-3-yl)-2,5-dioxo-1-pyrrolidinyl]-4-methylbenzoate IUPAC Name: 3-[(3S)-3-(1H-indol-3-yl)-2,5-dioxopyrrolidin-1-yl]-4-methylbenzoate Traditional Name: 3-[(3S)-3-(1H-indol-3-yl)-2,5-diketo-pyrrolidino]-4-methyl-benzoate Formula: C20H15N2O4- MolecularWeight: 347.3441

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])N2C(=O)CC(C2=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])N2C(=O)C[C@H](C2=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C20H16N2O4/c1-11-6-7-12(20(25)26)8-17(11)22-18(23)9-14(19(22)24)15-10-21-16-5-3-2-4-13(15)16/h2-8,10,14,21H,9H2,1H3,(H,25,26)/p-1/t14-/m0/s1