4-[4-[5-(3,4-dichlorophenyl)-2-methyl-3-phenyl-pyrrol-1-yl]phenyl]butanoic acid

Systemtic Name: 4-[4-[5-(3,4-dichlorophenyl)-2-methyl-3-phenyl-pyrrol-1-yl]phenyl]butanoic acid Openeye Name: 4-[4-[5-(3,4-dichlorophenyl)-2-methyl-3-phenyl-pyrrol-1-yl]phenyl]butanoic acid CAS Name: 4-[4-[5-(3,4-dichlorophenyl)-2-methyl-3-phenyl-1-pyrrolyl]phenyl]butanoic acid IUPAC Name: 4-[4-[5-(3,4-dichlorophenyl)-2-methyl-3-phenylpyrrol-1-yl]phenyl]butanoic acid Traditional Name: 4-[4-[5-(3,4-dichlorophenyl)-2-methyl-3-phenyl-pyrrol-1-yl]phenyl]butyric acid Formula: C27H23Cl2NO2 MolecularWeight: 464.38302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C2=CC=C(C=C2)CCCC(=O)O)C3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(N1C2=CC=C(C=C2)CCCC(=O)O)C3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4

InChI

InChI=1S/C27H23Cl2NO2/c1-18-23(20-7-3-2-4-8-20)17-26(21-12-15-24(28)25(29)16-21)30(18)22-13-10-19(11-14-22)6-5-9-27(31)32/h2-4,7-8,10-17H,5-6,9H2,1H3,(H,31,32)