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

Systemtic Name: 3-[3-[4-(3-azanylpropyl)piperazin-1-yl]propylamino]-2-methyl-5-oxidanyl-naphthalene-1,4-dione Openeye Name: 3-[3-[4-(3-aminopropyl)piperazin-1-yl]propylamino]-5-hydroxy-2-methyl-naphthalene-1,4-dione CAS Name: 3-[3-[4-(3-aminopropyl)-1-piperazinyl]propylamino]-5-hydroxy-2-methylnaphthalene-1,4-dione IUPAC Name: 3-[3-[4-(3-aminopropyl)piperazin-1-yl]propylamino]-5-hydroxy-2-methylnaphthalene-1,4-dione Traditional Name: 3-[3-[4-(3-aminopropyl)piperazino]propylamino]-5-hydroxy-2-methyl-1,4-naphthoquinone Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(C1=O)C=CC=C2O)NCCCN3CCN(CC3)CCCN

Isomeric SMILES

CC1=C(C(=O)C2=C(C1=O)C=CC=C2O)NCCCN3CCN(CC3)CCCN

InChI

InChI=1S/C21H30N4O3/c1-15-19(21(28)18-16(20(15)27)5-2-6-17(18)26)23-8-4-10-25-13-11-24(12-14-25)9-3-7-22/h2,5-6,23,26H,3-4,7-14,22H2,1H3