2-[3-(5-methyl-8-oxidanyl-6-oxidanylidene-phenanthridin-3-yl)propanoylamino]benzoic acid

Systemtic Name: 2-[3-(5-methyl-8-oxidanyl-6-oxidanylidene-phenanthridin-3-yl)propanoylamino]benzoic acid Openeye Name: 2-[3-(8-hydroxy-5-methyl-6-oxo-phenanthridin-3-yl)propanoylamino]benzoic acid CAS Name: 2-[[3-(8-hydroxy-5-methyl-6-oxo-3-phenanthridinyl)-1-oxopropyl]amino]benzoic acid IUPAC Name: 2-[3-(8-hydroxy-5-methyl-6-oxophenanthridin-3-yl)propanoylamino]benzoic acid Traditional Name: 2-[3-(8-hydroxy-6-keto-5-methyl-phenanthridin-3-yl)propanoylamino]benzoic acid Formula: C24H20N2O5 MolecularWeight: 416.426

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)CCC(=O)NC3=CC=CC=C3C(=O)O)C4=C(C1=O)C=C(C=C4)O

Isomeric SMILES

CN1C2=C(C=CC(=C2)CCC(=O)NC3=CC=CC=C3C(=O)O)C4=C(C1=O)C=C(C=C4)O

InChI

InChI=1S/C24H20N2O5/c1-26-21-12-14(6-9-17(21)16-10-8-15(27)13-19(16)23(26)29)7-11-22(28)25-20-5-3-2-4-18(20)24(30)31/h2-6,8-10,12-13,27H,7,11H2,1H3,(H,25,28)(H,30,31)