2-[5-methoxy-6-methyl-1-(phenylmethyl)-2-[[3-(trifluoromethyl)phenyl]methylamino]indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-methoxy-6-methyl-1-(phenylmethyl)-2-[[3-(trifluoromethyl)phenyl]methylamino]indol-3-yl]ethanoic acid Openeye Name: 2-[1-benzyl-5-methoxy-6-methyl-2-[[3-(trifluoromethyl)phenyl]methylamino]indol-3-yl]acetic acid CAS Name: 2-[5-methoxy-6-methyl-1-(phenylmethyl)-2-[[3-(trifluoromethyl)phenyl]methylamino]-3-indolyl]acetic acid IUPAC Name: 2-[1-benzyl-5-methoxy-6-methyl-2-[[3-(trifluoromethyl)phenyl]methylamino]indol-3-yl]acetic acid Traditional Name: 2-[1-benzyl-5-methoxy-6-methyl-2-[[3-(trifluoromethyl)benzyl]amino]indol-3-yl]acetic acid Formula: C27H25F3N2O3 MolecularWeight: 482.49421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)N(C(=C2CC(=O)O)NCC3=CC(=CC=C3)C(F)(F)F)CC4=CC=CC=C4)OC

Isomeric SMILES

CC1=C(C=C2C(=C1)N(C(=C2CC(=O)O)NCC3=CC(=CC=C3)C(F)(F)F)CC4=CC=CC=C4)OC

InChI

InChI=1S/C27H25F3N2O3/c1-17-11-23-21(13-24(17)35-2)22(14-25(33)34)26(32(23)16-18-7-4-3-5-8-18)31-15-19-9-6-10-20(12-19)27(28,29)30/h3-13,31H,14-16H2,1-2H3,(H,33,34)