4-[3-ethoxy-2-[[2-(1H-indol-2-ylcarbonylamino)phenyl]carbonylamino]-3-oxidanylidene-propyl]benzoic acid

Systemtic Name: 4-[3-ethoxy-2-[[2-(1H-indol-2-ylcarbonylamino)phenyl]carbonylamino]-3-oxidanylidene-propyl]benzoic acid Openeye Name: 4-[3-ethoxy-2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]-3-oxo-propyl]benzoic acid CAS Name: 4-[3-ethoxy-2-[[[2-[[1H-indol-2-yl(oxo)methyl]amino]phenyl]-oxomethyl]amino]-3-oxopropyl]benzoic acid IUPAC Name: 4-[3-ethoxy-2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]-3-oxopropyl]benzoic acid Traditional Name: 4-[3-ethoxy-2-[[2-(1H-indole-2-carbonylamino)benzoyl]amino]-3-keto-propyl]benzoic acid Formula: C28H25N3O6 MolecularWeight: 499.5146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=C(C=C1)C(=O)O)NC(=O)C2=CC=CC=C2NC(=O)C3=CC4=CC=CC=C4N3

Isomeric SMILES

CCOC(=O)C(CC1=CC=C(C=C1)C(=O)O)NC(=O)C2=CC=CC=C2NC(=O)C3=CC4=CC=CC=C4N3

InChI

InChI=1S/C28H25N3O6/c1-2-37-28(36)24(15-17-11-13-18(14-12-17)27(34)35)31-25(32)20-8-4-6-10-22(20)30-26(33)23-16-19-7-3-5-9-21(19)29-23/h3-14,16,24,29H,2,15H2,1H3,(H,30,33)(H,31,32)(H,34,35)