N-[[4-(2-methylpropoxy)phenyl]methyl]-2-nitro-aniline

Systemtic Name: N-[[4-(2-methylpropoxy)phenyl]methyl]-2-nitro-aniline Openeye Name: N-[(4-isobutoxyphenyl)methyl]-2-nitro-aniline CAS Name: N-[[4-(2-methylpropoxy)phenyl]methyl]-2-nitroaniline IUPAC Name: N-[[4-(2-methylpropoxy)phenyl]methyl]-2-nitroaniline Traditional Name: (4-isobutoxybenzyl)-(2-nitrophenyl)amine Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)CNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)CNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H20N2O3/c1-13(2)12-22-15-9-7-14(8-10-15)11-18-16-5-3-4-6-17(16)19(20)21/h3-10,13,18H,11-12H2,1-2H3