2,4-bis(oxidanylidene)pentanoic acid; 3-methylphenanthro[9,10-b]pyrazine

Systemtic Name: 2,4-bis(oxidanylidene)pentanoic acid; 3-methylphenanthro[9,10-b]pyrazine Openeye Name: 2,4-dioxopentanoic acid; 3-methylphenanthro[9,10-b]pyrazine CAS Name: 2,4-dioxopentanoic acid; 3-methylphenanthro[9,10-b]pyrazine IUPAC Name: 2,4-dioxopentanoic acid; 3-methylphenanthro[9,10-b]pyrazine Traditional Name: 2,4-diketovaleric acid; 3-methylphenanthro[9,10-b]pyrazine Formula: C22H18N2O4 MolecularWeight: 374.38932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C3=CC=CC=C3C4=CC=CC=C4C2=N1.CC(=O)CC(=O)C(=O)O

Isomeric SMILES

CC1=CN=C2C3=CC=CC=C3C4=CC=CC=C4C2=N1.CC(=O)CC(=O)C(=O)O

InChI

InChI=1S/C17H12N2.C5H6O4/c1-11-10-18-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)17(16)19-11;1-3(6)2-4(7)5(8)9/h2-10H,1H3;2H2,1H3,(H,8,9)