N-[(4-tert-butylphenyl)methyl]-5-chloranyl-2-nitro-aniline

Systemtic Name: N-[(4-tert-butylphenyl)methyl]-5-chloranyl-2-nitro-aniline Openeye Name: N-[(4-tert-butylphenyl)methyl]-5-chloro-2-nitro-aniline CAS Name: N-[(4-tert-butylphenyl)methyl]-5-chloro-2-nitroaniline IUPAC Name: N-[(4-tert-butylphenyl)methyl]-5-chloro-2-nitroaniline Traditional Name: (4-tert-butylbenzyl)-(5-chloro-2-nitro-phenyl)amine Formula: C17H19ClN2O2 MolecularWeight: 318.79796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN2O2/c1-17(2,3)13-6-4-12(5-7-13)11-19-15-10-14(18)8-9-16(15)20(21)22/h4-10,19H,11H2,1-3H3