[2-methyl-3-(phenylmethyl)pentadecan-2-yl]azanium dihydrate

Systemtic Name: [2-methyl-3-(phenylmethyl)pentadecan-2-yl]azanium dihydrate Openeye Name: (2-benzyl-1,1-dimethyl-tetradecyl)ammonium dihydrate CAS Name: [2-methyl-3-(phenylmethyl)pentadecan-2-yl]ammonium dihydrate IUPAC Name: (3-benzyl-2-methylpentadecan-2-yl)azanium dihydrate Traditional Name: (2-benzyl-1,1-dimethyl-tetradecyl)ammonium dihydrate Formula: C23H46NO2+ MolecularWeight: 368.61684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CC1=CC=CC=C1)C(C)(C)[NH3+].O.O

Isomeric SMILES

CCCCCCCCCCCCC(CC1=CC=CC=C1)C(C)(C)[NH3+].O.O

InChI

InChI=1S/C23H41N.2H2O/c1-4-5-6-7-8-9-10-11-12-16-19-22(23(2,3)24)20-21-17-14-13-15-18-21;;/h13-15,17-18,22H,4-12,16,19-20,24H2,1-3H3;2*1H2/p+1