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2-methylheptadecan-2-yl-[2-[(2-nitrophenyl)amino]ethyl]azanium

2-methylheptadecan-2-yl-[2-[(2-nitrophenyl)amino]ethyl]azanium

Systemtic Name:2-methylheptadecan-2-yl-[2-[(2-nitrophenyl)amino]ethyl]azanium
Openeye Name:1,1-dimethylhexadecyl-[2-(2-nitroanilino)ethyl]ammonium
CAS Name:2-methylheptadecan-2-yl-[2-(2-nitroanilino)ethyl]ammonium
IUPAC Name:2-methylheptadecan-2-yl-[2-(2-nitroanilino)ethyl]azanium
Traditional Name:1,1-dimethylhexadecyl-[2-(2-nitroanilino)ethyl]ammonium
Formula: C26H48N3O2+
MolecularWeight: 434.67822
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C)(C)[NH2+]CCNC1=CC=CC=C1[N+](=O)[O-]


Isomeric SMILES

CCCCCCCCCCCCCCCC(C)(C)[NH2+]CCNC1=CC=CC=C1[N+](=O)[O-]


InChI

InChI=1S/C26H47N3O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-18-21-26(2,3)28-23-22-27-24-19-16-17-20-25(24)29(30)31/h16-17,19-20,27-28H,4-15,18,21-23H2,1-3H3/p+1


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