2-[[5-[(2-methoxyphenyl)methylcarbamoyl]indol-1-yl]methyl]benzoic acid

Systemtic Name: 2-[[5-[(2-methoxyphenyl)methylcarbamoyl]indol-1-yl]methyl]benzoic acid Openeye Name: 2-[[5-[(2-methoxyphenyl)methylcarbamoyl]indol-1-yl]methyl]benzoic acid CAS Name: 2-[[5-[[(2-methoxyphenyl)methylamino]-oxomethyl]-1-indolyl]methyl]benzoic acid IUPAC Name: 2-[[5-[(2-methoxyphenyl)methylcarbamoyl]indol-1-yl]methyl]benzoic acid Traditional Name: 2-[[5-(o-anisylcarbamoyl)indol-1-yl]methyl]benzoic acid Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C2=CC3=C(C=C2)N(C=C3)CC4=CC=CC=C4C(=O)O

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C2=CC3=C(C=C2)N(C=C3)CC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C25H22N2O4/c1-31-23-9-5-3-6-19(23)15-26-24(28)18-10-11-22-17(14-18)12-13-27(22)16-20-7-2-4-8-21(20)25(29)30/h2-14H,15-16H2,1H3,(H,26,28)(H,29,30)