7-(cyclopropylcarbonylamino)-3-(4-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid

Systemtic Name: 7-(cyclopropylcarbonylamino)-3-(4-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid Openeye Name: 7-(cyclopropanecarbonylamino)-3-(4-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid CAS Name: 7-[[cyclopropyl(oxo)methyl]amino]-3-(4-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]-2-indolecarboxylic acid IUPAC Name: 7-(cyclopropanecarbonylamino)-3-(4-methoxyphenyl)-1-[(3-methoxyphenyl)methyl]indole-2-carboxylic acid Traditional Name: 7-(cyclopropanecarbonylamino)-1-m-anisyl-3-(4-methoxyphenyl)indole-2-carboxylic acid Formula: C28H26N2O5 MolecularWeight: 470.51644

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(N(C3=C2C=CC=C3NC(=O)C4CC4)CC5=CC(=CC=C5)OC)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(N(C3=C2C=CC=C3NC(=O)C4CC4)CC5=CC(=CC=C5)OC)C(=O)O

InChI

InChI=1S/C28H26N2O5/c1-34-20-13-11-18(12-14-20)24-22-7-4-8-23(29-27(31)19-9-10-19)25(22)30(26(24)28(32)33)16-17-5-3-6-21(15-17)35-2/h3-8,11-15,19H,9-10,16H2,1-2H3,(H,29,31)(H,32,33)