3-[3-(3-azanylpropylamino)propylamino]-2-methyl-5-oxidanyl-naphthalene-1,4-dione

Systemtic Name: 3-[3-(3-azanylpropylamino)propylamino]-2-methyl-5-oxidanyl-naphthalene-1,4-dione Openeye Name: 3-[3-(3-aminopropylamino)propylamino]-5-hydroxy-2-methyl-naphthalene-1,4-dione CAS Name: 3-[3-(3-aminopropylamino)propylamino]-5-hydroxy-2-methylnaphthalene-1,4-dione IUPAC Name: 3-[3-(3-aminopropylamino)propylamino]-5-hydroxy-2-methylnaphthalene-1,4-dione Traditional Name: 3-[3-(3-aminopropylamino)propylamino]-5-hydroxy-2-methyl-1,4-naphthoquinone Formula: C17H23N3O3 MolecularWeight: 317.38282

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C1=O)C=CC=C2O)NCCCNCCCN

Isomeric SMILES

CC1=C(C(=O)C2=C(C1=O)C=CC=C2O)NCCCNCCCN

InChI

InChI=1S/C17H23N3O3/c1-11-15(20-10-4-9-19-8-3-7-18)17(23)14-12(16(11)22)5-2-6-13(14)21/h2,5-6,19-21H,3-4,7-10,18H2,1H3