3-[(decylamino)methyl]-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-[(decylamino)methyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 3-[(decylamino)methyl]-4-hydroxy-naphthalene-1,2-dione CAS Name: 3-[(decylamino)methyl]-4-hydroxynaphthalene-1,2-dione IUPAC Name: 3-[(decylamino)methyl]-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-[(decylamino)methyl]-4-hydroxy-1,2-naphthoquinone Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNCC1=C(C2=CC=CC=C2C(=O)C1=O)O

Isomeric SMILES

CCCCCCCCCCNCC1=C(C2=CC=CC=C2C(=O)C1=O)O

InChI

InChI=1S/C21H29NO3/c1-2-3-4-5-6-7-8-11-14-22-15-18-19(23)16-12-9-10-13-17(16)20(24)21(18)25/h9-10,12-13,22-23H,2-8,11,14-15H2,1H3