5-chloranyl-2-nitro-N-(1-phenylbutyl)aniline

Systemtic Name: 5-chloranyl-2-nitro-N-(1-phenylbutyl)aniline Openeye Name: 5-chloro-2-nitro-N-(1-phenylbutyl)aniline CAS Name: 5-chloro-2-nitro-N-(1-phenylbutyl)aniline IUPAC Name: 5-chloro-2-nitro-N-(1-phenylbutyl)aniline Traditional Name: (5-chloro-2-nitro-phenyl)-(1-phenylbutyl)amine Formula: C16H17ClN2O2 MolecularWeight: 304.77138

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H17ClN2O2/c1-2-6-14(12-7-4-3-5-8-12)18-15-11-13(17)9-10-16(15)19(20)21/h3-5,7-11,14,18H,2,6H2,1H3