N-(2,6-dimethylheptan-4-yl)-4-methyl-3-nitro-aniline

Systemtic Name: N-(2,6-dimethylheptan-4-yl)-4-methyl-3-nitro-aniline Openeye Name: N-(1-isobutyl-3-methyl-butyl)-4-methyl-3-nitro-aniline CAS Name: N-(2,6-dimethylheptan-4-yl)-4-methyl-3-nitroaniline IUPAC Name: N-(2,6-dimethylheptan-4-yl)-4-methyl-3-nitroaniline Traditional Name: (1-isobutyl-3-methyl-butyl)-(4-methyl-3-nitro-phenyl)amine Formula: C16H26N2O2 MolecularWeight: 278.38984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(CC(C)C)CC(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(CC(C)C)CC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H26N2O2/c1-11(2)8-15(9-12(3)4)17-14-7-6-13(5)16(10-14)18(19)20/h6-7,10-12,15,17H,8-9H2,1-5H3