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

Systemtic Name: 4-[(2-chloranyl-5-nitro-4-piperidin-1-yl-phenyl)-phenyl-methyl]-N,N-dimethyl-aniline Openeye Name: 4-[[2-chloro-5-nitro-4-(1-piperidyl)phenyl]-phenyl-methyl]-N,N-dimethyl-aniline CAS Name: 4-[[2-chloro-5-nitro-4-(1-piperidinyl)phenyl]-phenylmethyl]-N,N-dimethylaniline IUPAC Name: 4-[(2-chloro-5-nitro-4-piperidin-1-ylphenyl)-phenylmethyl]-N,N-dimethylaniline Traditional Name: [4-[(2-chloro-5-nitro-4-piperidino-phenyl)-phenyl-methyl]phenyl]-dimethyl-amine Formula: C26H28ClN3O2 MolecularWeight: 449.97242

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC(=C(C=C3Cl)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC(=C(C=C3Cl)N4CCCCC4)[N+](=O)[O-]

InChI

InChI=1S/C26H28ClN3O2/c1-28(2)21-13-11-20(12-14-21)26(19-9-5-3-6-10-19)22-17-25(30(31)32)24(18-23(22)27)29-15-7-4-8-16-29/h3,5-6,9-14,17-18,26H,4,7-8,15-16H2,1-2H3