(3R)-1-[(3R)-5-methoxy-1-methyl-2,3-dihydroindol-3-yl]piperidin-1-ium-3-carbaldehyde

Systemtic Name: (3R)-1-[(3R)-5-methoxy-1-methyl-2,3-dihydroindol-3-yl]piperidin-1-ium-3-carbaldehyde Openeye Name: (3R)-1-[(3R)-5-methoxy-1-methyl-indolin-3-yl]piperidin-1-ium-3-carbaldehyde CAS Name: (3R)-1-[(3R)-5-methoxy-1-methyl-2,3-dihydroindol-3-yl]-3-piperidin-1-iumcarboxaldehyde IUPAC Name: (3R)-1-[(3R)-5-methoxy-1-methyl-2,3-dihydroindol-3-yl]piperidin-1-ium-3-carbaldehyde Traditional Name: (3R)-1-[(3R)-5-methoxy-1-methyl-indolin-3-yl]piperidin-1-ium-3-carbaldehyde Formula: C16H23N2O2+ MolecularWeight: 275.36602

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C2=C1C=CC(=C2)OC)[NH+]3CCCC(C3)C=O

Isomeric SMILES

CN1C[C@@H](C2=C1C=CC(=C2)OC)[NH+]3CCC[C@H](C3)C=O

InChI

InChI=1S/C16H22N2O2/c1-17-10-16(18-7-3-4-12(9-18)11-19)14-8-13(20-2)5-6-15(14)17/h5-6,8,11-12,16H,3-4,7,9-10H2,1-2H3/p+1/t12-,16+/m1/s1