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

Systemtic Name: 6-methoxy-3-[[(5-methylfuran-2-yl)methylamino]methyl]-1-(phenylmethyl)indole-2-carboxylic acid Openeye Name: 1-benzyl-6-methoxy-3-[[(5-methyl-2-furyl)methylamino]methyl]indole-2-carboxylic acid CAS Name: 6-methoxy-3-[[(5-methyl-2-furanyl)methylamino]methyl]-1-(phenylmethyl)-2-indolecarboxylic acid IUPAC Name: 1-benzyl-6-methoxy-3-[[(5-methylfuran-2-yl)methylamino]methyl]indole-2-carboxylic acid Traditional Name: 1-benzyl-6-methoxy-3-[[(5-methyl-2-furyl)methylamino]methyl]indole-2-carboxylic acid Formula: C24H24N2O4 MolecularWeight: 404.45836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNCC2=C(N(C3=C2C=CC(=C3)OC)CC4=CC=CC=C4)C(=O)O

Isomeric SMILES

CC1=CC=C(O1)CNCC2=C(N(C3=C2C=CC(=C3)OC)CC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H24N2O4/c1-16-8-9-19(30-16)13-25-14-21-20-11-10-18(29-2)12-22(20)26(23(21)24(27)28)15-17-6-4-3-5-7-17/h3-12,25H,13-15H2,1-2H3,(H,27,28)