[4-methyl-1-oxidanylidene-1-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]pentan-2-yl]azanium

Systemtic Name: [4-methyl-1-oxidanylidene-1-[[1-(phenylmethyl)piperidin-1-ium-4-yl]amino]pentan-2-yl]azanium Openeye Name: [1-[(1-benzylpiperidin-1-ium-4-yl)carbamoyl]-3-methyl-butyl]ammonium CAS Name: [4-methyl-1-oxo-1-[[1-(phenylmethyl)-4-piperidin-1-iumyl]amino]pentan-2-yl]ammonium IUPAC Name: [1-[(1-benzylpiperidin-1-ium-4-yl)amino]-4-methyl-1-oxopentan-2-yl]azanium Traditional Name: [1-[(1-benzylpiperidin-1-ium-4-yl)carbamoyl]-3-methyl-butyl]ammonium Formula: C18H31N3O+2 MolecularWeight: 305.45824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1CC[NH+](CC1)CC2=CC=CC=C2)[NH3+]

Isomeric SMILES

CC(C)CC(C(=O)NC1CC[NH+](CC1)CC2=CC=CC=C2)[NH3+]

InChI

InChI=1S/C18H29N3O/c1-14(2)12-17(19)18(22)20-16-8-10-21(11-9-16)13-15-6-4-3-5-7-15/h3-7,14,16-17H,8-13,19H2,1-2H3,(H,20,22)/p+2