dimethyl-[2-[4-[4-(3-oxidanylidenebutyl)phenoxy]butylazaniumyl]ethyl]azanium

Systemtic Name: dimethyl-[2-[4-[4-(3-oxidanylidenebutyl)phenoxy]butylazaniumyl]ethyl]azanium Openeye Name: dimethyl-[2-[4-[4-(3-oxobutyl)phenoxy]butylammonio]ethyl]ammonium CAS Name: dimethyl-[2-[4-[4-(3-oxobutyl)phenoxy]butylammonio]ethyl]ammonium IUPAC Name: dimethyl-[2-[4-[4-(3-oxobutyl)phenoxy]butylazaniumyl]ethyl]azanium Traditional Name: 2-[4-[4-(3-ketobutyl)phenoxy]butylammonio]ethyl-dimethyl-ammonium Formula: C18H32N2O2+2 MolecularWeight: 308.45888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC=C(C=C1)OCCCC[NH2+]CC[NH+](C)C

Isomeric SMILES

CC(=O)CCC1=CC=C(C=C1)OCCCC[NH2+]CC[NH+](C)C

InChI

InChI=1S/C18H30N2O2/c1-16(21)6-7-17-8-10-18(11-9-17)22-15-5-4-12-19-13-14-20(2)3/h8-11,19H,4-7,12-15H2,1-3H3/p+2