methyl 8-[[9,10-bis(oxidanylidene)phenanthren-3-yl]amino]-8-oxidanylidene-octanoate

Systemtic Name: methyl 8-[[9,10-bis(oxidanylidene)phenanthren-3-yl]amino]-8-oxidanylidene-octanoate Openeye Name: methyl 8-[(9,10-dioxo-3-phenanthryl)amino]-8-oxo-octanoate CAS Name: 8-[(9,10-dioxo-3-phenanthrenyl)amino]-8-oxooctanoic acid methyl ester IUPAC Name: methyl 8-[(9,10-dioxophenanthren-3-yl)amino]-8-oxooctanoate Traditional Name: 8-[(9,10-diketo-3-phenanthryl)amino]-8-keto-caprylic acid methyl ester Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCC(=O)NC1=CC2=C(C=C1)C(=O)C(=O)C3=CC=CC=C32

Isomeric SMILES

COC(=O)CCCCCCC(=O)NC1=CC2=C(C=C1)C(=O)C(=O)C3=CC=CC=C32

InChI

InChI=1S/C23H23NO5/c1-29-21(26)11-5-3-2-4-10-20(25)24-15-12-13-18-19(14-15)16-8-6-7-9-17(16)22(27)23(18)28/h6-9,12-14H,2-5,10-11H2,1H3,(H,24,25)