2-(hexylamino)-6-(4-methylpentyl)naphthalene-1,4-dione

Systemtic Name: 2-(hexylamino)-6-(4-methylpentyl)naphthalene-1,4-dione Openeye Name: 2-(hexylamino)-6-isohexyl-naphthalene-1,4-dione CAS Name: 2-(hexylamino)-6-(4-methylpentyl)naphthalene-1,4-dione IUPAC Name: 2-(hexylamino)-6-(4-methylpentyl)naphthalene-1,4-dione Traditional Name: 2-(hexylamino)-6-isohexyl-1,4-naphthoquinone Formula: C22H31NO2 MolecularWeight: 341.48704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=CC(=O)C2=C(C1=O)C=CC(=C2)CCCC(C)C

Isomeric SMILES

CCCCCCNC1=CC(=O)C2=C(C1=O)C=CC(=C2)CCCC(C)C

InChI

InChI=1S/C22H31NO2/c1-4-5-6-7-13-23-20-15-21(24)19-14-17(10-8-9-16(2)3)11-12-18(19)22(20)25/h11-12,14-16,23H,4-10,13H2,1-3H3