4-[(2-chloranyl-5-nitro-phenyl)-(4-pyrrolidin-1-ylphenyl)methyl]-N,N-dimethyl-aniline

Systemtic Name: 4-[(2-chloranyl-5-nitro-phenyl)-(4-pyrrolidin-1-ylphenyl)methyl]-N,N-dimethyl-aniline Openeye Name: 4-[(2-chloro-5-nitro-phenyl)-(4-pyrrolidin-1-ylphenyl)methyl]-N,N-dimethyl-aniline CAS Name: 4-[(2-chloro-5-nitrophenyl)-[4-(1-pyrrolidinyl)phenyl]methyl]-N,N-dimethylaniline IUPAC Name: 4-[(2-chloro-5-nitrophenyl)-(4-pyrrolidin-1-ylphenyl)methyl]-N,N-dimethylaniline Traditional Name: [4-[(2-chloro-5-nitro-phenyl)-(4-pyrrolidinophenyl)methyl]phenyl]-dimethyl-amine Formula: C25H26ClN3O2 MolecularWeight: 435.94584

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N3CCCC3)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N3CCCC3)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C25H26ClN3O2/c1-27(2)20-9-5-18(6-10-20)25(23-17-22(29(30)31)13-14-24(23)26)19-7-11-21(12-8-19)28-15-3-4-16-28/h5-14,17,25H,3-4,15-16H2,1-2H3