4-oxidanyl-3-(9-oxidanylideneheptadecyl)naphthalene-1,2-dione

Systemtic Name: 4-oxidanyl-3-(9-oxidanylideneheptadecyl)naphthalene-1,2-dione Openeye Name: 4-hydroxy-3-(9-oxoheptadecyl)naphthalene-1,2-dione CAS Name: 4-hydroxy-3-(9-oxoheptadecyl)naphthalene-1,2-dione IUPAC Name: 4-hydroxy-3-(9-oxoheptadecyl)naphthalene-1,2-dione Traditional Name: 4-hydroxy-3-(9-ketoheptadecyl)-1,2-naphthoquinone Formula: C27H38O4 MolecularWeight: 426.58822

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)CCCCCCCCC1=C(C2=CC=CC=C2C(=O)C1=O)O

Isomeric SMILES

CCCCCCCCC(=O)CCCCCCCCC1=C(C2=CC=CC=C2C(=O)C1=O)O

InChI

InChI=1S/C27H38O4/c1-2-3-4-5-8-11-16-21(28)17-12-9-6-7-10-13-20-24-25(29)22-18-14-15-19-23(22)26(30)27(24)31/h14-15,18-19,29H,2-13,16-17,20H2,1H3