3-[1-[(4-chlorophenyl)methyl]-3-methyl-5-oxidanyl-indol-2-yl]butanoic acid

Systemtic Name: 3-[1-[(4-chlorophenyl)methyl]-3-methyl-5-oxidanyl-indol-2-yl]butanoic acid Openeye Name: 3-[1-[(4-chlorophenyl)methyl]-5-hydroxy-3-methyl-indol-2-yl]butanoic acid CAS Name: 3-[1-[(4-chlorophenyl)methyl]-5-hydroxy-3-methyl-2-indolyl]butanoic acid IUPAC Name: 3-[1-[(4-chlorophenyl)methyl]-5-hydroxy-3-methylindol-2-yl]butanoic acid Traditional Name: 3-[1-(4-chlorobenzyl)-5-hydroxy-3-methyl-indol-2-yl]butyric acid Formula: C20H20ClNO3 MolecularWeight: 357.8307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)Cl)C(C)CC(=O)O

Isomeric SMILES

CC1=C(N(C2=C1C=C(C=C2)O)CC3=CC=C(C=C3)Cl)C(C)CC(=O)O

InChI

InChI=1S/C20H20ClNO3/c1-12(9-19(24)25)20-13(2)17-10-16(23)7-8-18(17)22(20)11-14-3-5-15(21)6-4-14/h3-8,10,12,23H,9,11H2,1-2H3,(H,24,25)