1-(3-nitro-4-pyrrolidin-1-yl-phenyl)-N-(4-octoxyphenyl)methanimine

Systemtic Name: 1-(3-nitro-4-pyrrolidin-1-yl-phenyl)-N-(4-octoxyphenyl)methanimine Openeye Name: 1-(3-nitro-4-pyrrolidin-1-yl-phenyl)-N-(4-octoxyphenyl)methanimine CAS Name: 1-[3-nitro-4-(1-pyrrolidinyl)phenyl]-N-(4-octoxyphenyl)methanimine IUPAC Name: 1-(3-nitro-4-pyrrolidin-1-ylphenyl)-N-(4-octoxyphenyl)methanimine Traditional Name: (3-nitro-4-pyrrolidino-benzylidene)-(4-octoxyphenyl)amine Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)N=CC2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)N=CC2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C25H33N3O3/c1-2-3-4-5-6-9-18-31-23-13-11-22(12-14-23)26-20-21-10-15-24(25(19-21)28(29)30)27-16-7-8-17-27/h10-15,19-20H,2-9,16-18H2,1H3