4-[4-[4-(dimethylamino)butyl]-3-nitro-phenyl]-N,N-dimethyl-butan-1-amine

Systemtic Name: 4-[4-[4-(dimethylamino)butyl]-3-nitro-phenyl]-N,N-dimethyl-butan-1-amine Openeye Name: 4-[4-[4-(dimethylamino)butyl]-3-nitro-phenyl]-N,N-dimethyl-butan-1-amine CAS Name: 4-[4-[4-(dimethylamino)butyl]-3-nitrophenyl]-N,N-dimethyl-1-butanamine IUPAC Name: 4-[4-[4-(dimethylamino)butyl]-3-nitrophenyl]-N,N-dimethylbutan-1-amine Traditional Name: 4-[4-[4-(dimethylamino)butyl]-2-nitro-phenyl]butyl-dimethyl-amine Formula: C18H31N3O2 MolecularWeight: 321.45764

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCC1=CC(=C(C=C1)CCCCN(C)C)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCCCC1=CC(=C(C=C1)CCCCN(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H31N3O2/c1-19(2)13-7-5-9-16-11-12-17(18(15-16)21(22)23)10-6-8-14-20(3)4/h11-12,15H,5-10,13-14H2,1-4H3