8-[[9,10-bis(oxidanylidene)phenanthren-4-yl]amino]-8-oxidanylidene-octanoic acid

Systemtic Name: 8-[[9,10-bis(oxidanylidene)phenanthren-4-yl]amino]-8-oxidanylidene-octanoic acid Openeye Name: 8-[(9,10-dioxo-4-phenanthryl)amino]-8-oxo-octanoic acid CAS Name: 8-[(9,10-dioxo-4-phenanthrenyl)amino]-8-oxooctanoic acid IUPAC Name: 8-[(9,10-dioxophenanthren-4-yl)amino]-8-oxooctanoic acid Traditional Name: 8-[(9,10-diketo-4-phenanthryl)amino]-8-keto-caprylic acid Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=CC=C3NC(=O)CCCCCCC(=O)O)C(=O)C2=O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=CC=C3NC(=O)CCCCCCC(=O)O)C(=O)C2=O

InChI

InChI=1S/C22H21NO5/c24-18(12-3-1-2-4-13-19(25)26)23-17-11-7-10-16-20(17)14-8-5-6-9-15(14)21(27)22(16)28/h5-11H,1-4,12-13H2,(H,23,24)(H,25,26)