4-[bis[3-(4-chlorophenyl)propyl]amino]benzoic acid

Systemtic Name: 4-[bis[3-(4-chlorophenyl)propyl]amino]benzoic acid Openeye Name: 4-[bis[3-(4-chlorophenyl)propyl]amino]benzoic acid CAS Name: 4-[bis[3-(4-chlorophenyl)propyl]amino]benzoic acid IUPAC Name: 4-[bis[3-(4-chlorophenyl)propyl]amino]benzoic acid Traditional Name: 4-[bis[3-(4-chlorophenyl)propyl]amino]benzoic acid Formula: C25H25Cl2NO2 MolecularWeight: 442.3775

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCN(CCCC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1CCCN(CCCC2=CC=C(C=C2)Cl)C3=CC=C(C=C3)C(=O)O)Cl

InChI

InChI=1S/C25H25Cl2NO2/c26-22-11-5-19(6-12-22)3-1-17-28(24-15-9-21(10-16-24)25(29)30)18-2-4-20-7-13-23(27)14-8-20/h5-16H,1-4,17-18H2,(H,29,30)