N-[(2-chloranyl-5-nitro-phenyl)methyl]-4-propyl-aniline

Systemtic Name: N-[(2-chloranyl-5-nitro-phenyl)methyl]-4-propyl-aniline Openeye Name: N-[(2-chloro-5-nitro-phenyl)methyl]-4-propyl-aniline CAS Name: N-[(2-chloro-5-nitrophenyl)methyl]-4-propylaniline IUPAC Name: N-[(2-chloro-5-nitrophenyl)methyl]-4-propylaniline Traditional Name: (2-chloro-5-nitro-benzyl)-(4-propylphenyl)amine Formula: C16H17ClN2O2 MolecularWeight: 304.77138

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)NCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H17ClN2O2/c1-2-3-12-4-6-14(7-5-12)18-11-13-10-15(19(20)21)8-9-16(13)17/h4-10,18H,2-3,11H2,1H3