[4-(phenylmethyl)piperidin-1-yl]-[(3S)-piperidin-1-ium-3-yl]methanone

Systemtic Name: [4-(phenylmethyl)piperidin-1-yl]-[(3S)-piperidin-1-ium-3-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-[(3S)-piperidin-1-ium-3-yl]methanone CAS Name: [4-(phenylmethyl)-1-piperidinyl]-[(3S)-3-piperidin-1-iumyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-[(3S)-piperidin-1-ium-3-yl]methanone Traditional Name: (4-benzylpiperidino)-[(3S)-piperidin-1-ium-3-yl]methanone Formula: C18H27N2O+ MolecularWeight: 287.41978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C(=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H26N2O/c21-18(17-7-4-10-19-14-17)20-11-8-16(9-12-20)13-15-5-2-1-3-6-15/h1-3,5-6,16-17,19H,4,7-14H2/p+1/t17-/m0/s1