2-[3-(4-azaniumylpiperidin-1-yl)carbonylphenoxy]ethyl-diethyl-azanium

Systemtic Name: 2-[3-(4-azaniumylpiperidin-1-yl)carbonylphenoxy]ethyl-diethyl-azanium Openeye Name: 2-[3-(4-azaniumylpiperidine-1-carbonyl)phenoxy]ethyl-diethyl-ammonium CAS Name: 2-[3-[(4-ammonio-1-piperidinyl)-oxomethyl]phenoxy]ethyl-diethylammonium IUPAC Name: 2-[3-(4-azaniumylpiperidine-1-carbonyl)phenoxy]ethyl-diethylazanium Traditional Name: 2-[3-(4-ammoniopiperidine-1-carbonyl)phenoxy]ethyl-diethyl-ammonium Formula: C18H31N3O2+2 MolecularWeight: 321.45764

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=CC=CC(=C1)C(=O)N2CCC(CC2)[NH3+]

Isomeric SMILES

CC[NH+](CC)CCOC1=CC=CC(=C1)C(=O)N2CCC(CC2)[NH3+]

InChI

InChI=1S/C18H29N3O2/c1-3-20(4-2)12-13-23-17-7-5-6-15(14-17)18(22)21-10-8-16(19)9-11-21/h5-7,14,16H,3-4,8-13,19H2,1-2H3/p+2