N-heptyl-4-methyl-3-nitro-aniline

Systemtic Name: N-heptyl-4-methyl-3-nitro-aniline Openeye Name: N-heptyl-4-methyl-3-nitro-aniline CAS Name: N-heptyl-4-methyl-3-nitroaniline IUPAC Name: N-heptyl-4-methyl-3-nitroaniline Traditional Name: heptyl-(4-methyl-3-nitro-phenyl)amine Formula: C14H22N2O2 MolecularWeight: 250.33668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=CC(=C(C=C1)C)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCNC1=CC(=C(C=C1)C)[N+](=O)[O-]

InChI

InChI=1S/C14H22N2O2/c1-3-4-5-6-7-10-15-13-9-8-12(2)14(11-13)16(17)18/h8-9,11,15H,3-7,10H2,1-2H3