1-[(1S)-2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(1S)-2-(2-methyl-1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-(2-methyl-1H-indol-3-yl)-2-oxo-1-phenyl-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(1S)-2-(2-methyl-1H-indol-3-yl)-2-oxo-1-phenylethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1S)-2-(2-methyl-1H-indol-3-yl)-2-oxo-1-phenylethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-keto-2-(2-methyl-1H-indol-3-yl)-1-phenyl-ethyl]piperidin-1-ium-4-carboxamide Formula: C23H26N3O2+ MolecularWeight: 376.47144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(C3=CC=CC=C3)[NH+]4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)[C@H](C3=CC=CC=C3)[NH+]4CCC(CC4)C(=O)N

InChI

InChI=1S/C23H25N3O2/c1-15-20(18-9-5-6-10-19(18)25-15)22(27)21(16-7-3-2-4-8-16)26-13-11-17(12-14-26)23(24)28/h2-10,17,21,25H,11-14H2,1H3,(H2,24,28)/p+1/t21-/m0/s1