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

Systemtic Name: (3R)-1-[(1-propan-2-yl-2,3-dihydroindol-5-yl)methyl]piperidin-1-ium-3-carboxamide Openeye Name: (3R)-1-[(1-isopropylindolin-5-yl)methyl]piperidin-1-ium-3-carboxamide CAS Name: (3R)-1-[(1-propan-2-yl-2,3-dihydroindol-5-yl)methyl]-3-piperidin-1-iumcarboxamide IUPAC Name: (3R)-1-[(1-propan-2-yl-2,3-dihydroindol-5-yl)methyl]piperidin-1-ium-3-carboxamide Traditional Name: (3R)-1-[(1-isopropylindolin-5-yl)methyl]piperidin-1-ium-3-carboxamide Formula: C18H28N3O+ MolecularWeight: 302.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC2=C1C=CC(=C2)C[NH+]3CCCC(C3)C(=O)N

Isomeric SMILES

CC(C)N1CCC2=C1C=CC(=C2)C[NH+]3CCC[C@H](C3)C(=O)N

InChI

InChI=1S/C18H27N3O/c1-13(2)21-9-7-15-10-14(5-6-17(15)21)11-20-8-3-4-16(12-20)18(19)22/h5-6,10,13,16H,3-4,7-9,11-12H2,1-2H3,(H2,19,22)/p+1/t16-/m1/s1