3-nitro-4-(pyridin-2-ylmethyl)-N-tetradecyl-aniline

Systemtic Name: 3-nitro-4-(pyridin-2-ylmethyl)-N-tetradecyl-aniline Openeye Name: 3-nitro-4-(2-pyridylmethyl)-N-tetradecyl-aniline CAS Name: 3-nitro-4-(2-pyridinylmethyl)-N-tetradecylaniline IUPAC Name: 3-nitro-4-(pyridin-2-ylmethyl)-N-tetradecylaniline Traditional Name: myristyl-[3-nitro-4-(2-pyridylmethyl)phenyl]amine Formula: C26H39N3O2 MolecularWeight: 425.60676

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCNC1=CC(=C(C=C1)CC2=CC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCNC1=CC(=C(C=C1)CC2=CC=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C26H39N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-14-19-28-25-18-17-23(26(22-25)29(30)31)21-24-16-13-15-20-27-24/h13,15-18,20,22,28H,2-12,14,19,21H2,1H3