[(2R,3S)-3-methyl-1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]pentan-2-yl]azanium

Systemtic Name: [(2R,3S)-3-methyl-1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]pentan-2-yl]azanium Openeye Name: [(1R,2S)-1-(4-benzylpiperidine-1-carbonyl)-2-methyl-butyl]ammonium CAS Name: [(2R,3S)-3-methyl-1-oxo-1-[4-(phenylmethyl)-1-piperidinyl]pentan-2-yl]ammonium IUPAC Name: [(2R,3S)-1-(4-benzylpiperidin-1-yl)-3-methyl-1-oxopentan-2-yl]azanium Traditional Name: [(1R,2S)-1-(4-benzylpiperidine-1-carbonyl)-2-methyl-butyl]ammonium Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)N1CCC(CC1)CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)N1CCC(CC1)CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C18H28N2O/c1-3-14(2)17(19)18(21)20-11-9-16(10-12-20)13-15-7-5-4-6-8-15/h4-8,14,16-17H,3,9-13,19H2,1-2H3/p+1/t14-,17+/m0/s1