1-[(4-fluorophenyl)methyl]-6-methyl-3-[[(5-methylfuran-2-yl)methylamino]methyl]indole-2-carboxylic acid

Systemtic Name: 1-[(4-fluorophenyl)methyl]-6-methyl-3-[[(5-methylfuran-2-yl)methylamino]methyl]indole-2-carboxylic acid Openeye Name: 1-[(4-fluorophenyl)methyl]-6-methyl-3-[[(5-methyl-2-furyl)methylamino]methyl]indole-2-carboxylic acid CAS Name: 1-[(4-fluorophenyl)methyl]-6-methyl-3-[[(5-methyl-2-furanyl)methylamino]methyl]-2-indolecarboxylic acid IUPAC Name: 1-[(4-fluorophenyl)methyl]-6-methyl-3-[[(5-methylfuran-2-yl)methylamino]methyl]indole-2-carboxylic acid Traditional Name: 1-(4-fluorobenzyl)-6-methyl-3-[[(5-methyl-2-furyl)methylamino]methyl]indole-2-carboxylic acid Formula: C24H23FN2O3 MolecularWeight: 406.449423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2CC3=CC=C(C=C3)F)C(=O)O)CNCC4=CC=C(O4)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2CC3=CC=C(C=C3)F)C(=O)O)CNCC4=CC=C(O4)C

InChI

InChI=1S/C24H23FN2O3/c1-15-3-10-20-21(13-26-12-19-9-4-16(2)30-19)23(24(28)29)27(22(20)11-15)14-17-5-7-18(25)8-6-17/h3-11,26H,12-14H2,1-2H3,(H,28,29)