2-[3-(4-methylpiperazin-1-yl)propylamino]naphthalene-1,4-dione

Systemtic Name: 2-[3-(4-methylpiperazin-1-yl)propylamino]naphthalene-1,4-dione Openeye Name: 2-[3-(4-methylpiperazin-1-yl)propylamino]naphthalene-1,4-dione CAS Name: 2-[3-(4-methyl-1-piperazinyl)propylamino]naphthalene-1,4-dione IUPAC Name: 2-[3-(4-methylpiperazin-1-yl)propylamino]naphthalene-1,4-dione Traditional Name: 2-[3-(4-methylpiperazino)propylamino]-1,4-naphthoquinone Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC2=CC(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CN1CCN(CC1)CCCNC2=CC(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C18H23N3O2/c1-20-9-11-21(12-10-20)8-4-7-19-16-13-17(22)14-5-2-3-6-15(14)18(16)23/h2-3,5-6,13,19H,4,7-12H2,1H3