3-methoxy-4-[[6-(5-oxidanylidenehexanoylamino)indol-1-yl]methyl]benzoic acid

Systemtic Name: 3-methoxy-4-[[6-(5-oxidanylidenehexanoylamino)indol-1-yl]methyl]benzoic acid Openeye Name: 3-methoxy-4-[[6-(5-oxohexanoylamino)indol-1-yl]methyl]benzoic acid CAS Name: 4-[[6-(1,5-dioxohexylamino)-1-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 3-methoxy-4-[[6-(5-oxohexanoylamino)indol-1-yl]methyl]benzoic acid Traditional Name: 4-[[6-(5-ketohexanoylamino)indol-1-yl]methyl]-3-methoxy-benzoic acid Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCC(=O)NC1=CC2=C(C=C1)C=CN2CC3=C(C=C(C=C3)C(=O)O)OC

Isomeric SMILES

CC(=O)CCCC(=O)NC1=CC2=C(C=C1)C=CN2CC3=C(C=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C23H24N2O5/c1-15(26)4-3-5-22(27)24-19-9-8-16-10-11-25(20(16)13-19)14-18-7-6-17(23(28)29)12-21(18)30-2/h6-13H,3-5,14H2,1-2H3,(H,24,27)(H,28,29)