2-[6-chloranyl-1-[(4-cyanophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[6-chloranyl-1-[(4-cyanophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]ethanoic acid Openeye Name: 2-[6-chloro-1-[(4-cyanophenyl)methyl]-5-methoxy-2-methyl-indol-3-yl]acetic acid CAS Name: 2-[6-chloro-1-[(4-cyanophenyl)methyl]-5-methoxy-2-methyl-3-indolyl]acetic acid IUPAC Name: 2-[6-chloro-1-[(4-cyanophenyl)methyl]-5-methoxy-2-methylindol-3-yl]acetic acid Traditional Name: 2-[6-chloro-1-(4-cyanobenzyl)-5-methoxy-2-methyl-indol-3-yl]acetic acid Formula: C20H17ClN2O3 MolecularWeight: 368.81358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC(=C(C=C2N1CC3=CC=C(C=C3)C#N)Cl)OC)CC(=O)O

Isomeric SMILES

CC1=C(C2=CC(=C(C=C2N1CC3=CC=C(C=C3)C#N)Cl)OC)CC(=O)O

InChI

InChI=1S/C20H17ClN2O3/c1-12-15(8-20(24)25)16-7-19(26-2)17(21)9-18(16)23(12)11-14-5-3-13(10-22)4-6-14/h3-7,9H,8,11H2,1-2H3,(H,24,25)