13-dodecylpentacosan-13-ylazanium nitrite

Systemtic Name: 13-dodecylpentacosan-13-ylazanium nitrite Openeye Name: 1,1-didodecyltridecylammonium nitrite CAS Name: 13-dodecylpentacosan-13-ylammonium nitrite IUPAC Name: 13-dodecylpentacosan-13-ylazanium nitrite Traditional Name: 1,1-dilauryltridecylammonium nitrite Formula: C37H78N2O2 MolecularWeight: 583.02742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCCCCC)(CCCCCCCCCCCC)[NH3+].N(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCCCCC)(CCCCCCCCCCCC)[NH3+].N(=O)[O-]

InChI

InChI=1S/C37H77N.HNO2/c1-4-7-10-13-16-19-22-25-28-31-34-37(38,35-32-29-26-23-20-17-14-11-8-5-2)36-33-30-27-24-21-18-15-12-9-6-3;2-1-3/h4-36,38H2,1-3H3;(H,2,3)