dimethyl-[(1S)-2-[2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoylamino]-1-phenyl-ethyl]azanium

Systemtic Name: dimethyl-[(1S)-2-[2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoylamino]-1-phenyl-ethyl]azanium Openeye Name: dimethyl-[(1S)-2-[[2-(1-methylene-3-oxo-isoindolin-2-yl)acetyl]amino]-1-phenyl-ethyl]ammonium CAS Name: dimethyl-[(1S)-2-[[2-(1-methylene-3-oxo-2-isoindolyl)-1-oxoethyl]amino]-1-phenylethyl]ammonium IUPAC Name: dimethyl-[(1S)-2-[[2-(1-methylidene-3-oxoisoindol-2-yl)acetyl]amino]-1-phenylethyl]azanium Traditional Name: [(1S)-2-[[2-(1-keto-3-methylene-isoindolin-2-yl)acetyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)CN1C(=C)C2=CC=CC=C2C1=O)C3=CC=CC=C3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)CN1C(=C)C2=CC=CC=C2C1=O)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O2/c1-15-17-11-7-8-12-18(17)21(26)24(15)14-20(25)22-13-19(23(2)3)16-9-5-4-6-10-16/h4-12,19H,1,13-14H2,2-3H3,(H,22,25)/p+1/t19-/m1/s1