4-[[[5-(2-ethoxycarbonyl-1H-indol-5-yl)-1-methyl-pyrazol-3-yl]carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[[5-(2-ethoxycarbonyl-1H-indol-5-yl)-1-methyl-pyrazol-3-yl]carbonylamino]methyl]benzoic acid Openeye Name: 4-[[[5-(2-ethoxycarbonyl-1H-indol-5-yl)-1-methyl-pyrazole-3-carbonyl]amino]methyl]benzoic acid CAS Name: 4-[[[[5-(2-ethoxycarbonyl-1H-indol-5-yl)-1-methyl-3-pyrazolyl]-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[5-(2-ethoxycarbonyl-1H-indol-5-yl)-1-methylpyrazole-3-carbonyl]amino]methyl]benzoic acid Traditional Name: 4-[[[5-(2-carbethoxy-1H-indol-5-yl)-1-methyl-pyrazole-3-carbonyl]amino]methyl]benzoic acid Formula: C24H22N4O5 MolecularWeight: 446.45528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1)C=CC(=C2)C3=CC(=NN3C)C(=O)NCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1)C=CC(=C2)C3=CC(=NN3C)C(=O)NCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H22N4O5/c1-3-33-24(32)20-11-17-10-16(8-9-18(17)26-20)21-12-19(27-28(21)2)22(29)25-13-14-4-6-15(7-5-14)23(30)31/h4-12,26H,3,13H2,1-2H3,(H,25,29)(H,30,31)