3-[[2-(furan-2-yl)ethylamino]methyl]-6-methyl-1-(phenylmethyl)indole-2-carboxylic acid

Systemtic Name: 3-[[2-(furan-2-yl)ethylamino]methyl]-6-methyl-1-(phenylmethyl)indole-2-carboxylic acid Openeye Name: 1-benzyl-3-[[2-(2-furyl)ethylamino]methyl]-6-methyl-indole-2-carboxylic acid CAS Name: 3-[[2-(2-furanyl)ethylamino]methyl]-6-methyl-1-(phenylmethyl)-2-indolecarboxylic acid IUPAC Name: 1-benzyl-3-[[2-(furan-2-yl)ethylamino]methyl]-6-methylindole-2-carboxylic acid Traditional Name: 1-benzyl-3-[[2-(2-furyl)ethylamino]methyl]-6-methyl-indole-2-carboxylic acid Formula: C24H24N2O3 MolecularWeight: 388.45896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(N2CC3=CC=CC=C3)C(=O)O)CNCCC4=CC=CO4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(N2CC3=CC=CC=C3)C(=O)O)CNCCC4=CC=CO4

InChI

InChI=1S/C24H24N2O3/c1-17-9-10-20-21(15-25-12-11-19-8-5-13-29-19)23(24(27)28)26(22(20)14-17)16-18-6-3-2-4-7-18/h2-10,13-14,25H,11-12,15-16H2,1H3,(H,27,28)