1-[(2S)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[(2S)-1-(5-methoxy-1,2-dimethyl-indol-3-yl)-1-oxidanylidene-propan-2-yl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-(5-methoxy-1,2-dimethyl-indol-3-yl)-1-methyl-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[(2S)-1-(5-methoxy-1,2-dimethyl-3-indolyl)-1-oxopropan-2-yl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(2S)-1-(5-methoxy-1,2-dimethylindol-3-yl)-1-oxopropan-2-yl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-keto-2-(5-methoxy-1,2-dimethyl-indol-3-yl)-1-methyl-ethyl]piperidin-1-ium-4-carboxamide Formula: C20H28N3O3+ MolecularWeight: 358.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)C(C)[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CC1=C(C2=C(N1C)C=CC(=C2)OC)C(=O)[C@H](C)[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C20H27N3O3/c1-12-18(16-11-15(26-4)5-6-17(16)22(12)3)19(24)13(2)23-9-7-14(8-10-23)20(21)25/h5-6,11,13-14H,7-10H2,1-4H3,(H2,21,25)/p+1/t13-/m0/s1