2-[4-chloranyl-7-methyl-2-(3-phenylmethoxyphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[4-chloranyl-7-methyl-2-(3-phenylmethoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(3-benzyloxyphenyl)-4-chloro-7-methyl-1H-indol-3-yl]acetic acid CAS Name: 2-[4-chloro-7-methyl-2-(3-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[4-chloro-7-methyl-2-(3-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(3-benzoxyphenyl)-4-chloro-7-methyl-1H-indol-3-yl]acetic acid Formula: C24H20ClNO3 MolecularWeight: 405.8735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)C(=C(N2)C3=CC(=CC=C3)OCC4=CC=CC=C4)CC(=O)O

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)C(=C(N2)C3=CC(=CC=C3)OCC4=CC=CC=C4)CC(=O)O

InChI

InChI=1S/C24H20ClNO3/c1-15-10-11-20(25)22-19(13-21(27)28)24(26-23(15)22)17-8-5-9-18(12-17)29-14-16-6-3-2-4-7-16/h2-12,26H,13-14H2,1H3,(H,27,28)