1-(carboxymethyl)-3-(2-methoxycarbonylcyclopenten-1-yl)-2-[3-(3-methoxycarbonylphenoxy)propyl]indole-6-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-3-(2-methoxycarbonylcyclopenten-1-yl)-2-[3-(3-methoxycarbonylphenoxy)propyl]indole-6-carboxylic acid Openeye Name: 1-(carboxymethyl)-3-(2-methoxycarbonylcyclopenten-1-yl)-2-[3-(3-methoxycarbonylphenoxy)propyl]indole-6-carboxylic acid CAS Name: 1-(carboxymethyl)-3-(2-methoxycarbonyl-1-cyclopentenyl)-2-[3-(3-methoxycarbonylphenoxy)propyl]-6-indolecarboxylic acid IUPAC Name: 1-(carboxymethyl)-3-(2-methoxycarbonylcyclopenten-1-yl)-2-[3-(3-methoxycarbonylphenoxy)propyl]indole-6-carboxylic acid Traditional Name: 3-(2-carbomethoxycyclopenten-1-yl)-2-[3-(3-carbomethoxyphenoxy)propyl]-1-(carboxymethyl)indole-6-carboxylic acid Formula: C29H29NO9 MolecularWeight: 535.54186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CCC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)O)CCCOC4=CC=CC(=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(CCC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)O)CCCOC4=CC=CC(=C4)C(=O)OC

InChI

InChI=1S/C29H29NO9/c1-37-28(35)18-6-3-7-19(14-18)39-13-5-10-23-26(20-8-4-9-21(20)29(36)38-2)22-12-11-17(27(33)34)15-24(22)30(23)16-25(31)32/h3,6-7,11-12,14-15H,4-5,8-10,13,16H2,1-2H3,(H,31,32)(H,33,34)