2-methyl-3-[4-(phenylmethyl)piperazin-1-yl]naphthalene-1,4-dione

Systemtic Name: 2-methyl-3-[4-(phenylmethyl)piperazin-1-yl]naphthalene-1,4-dione Openeye Name: 2-(4-benzylpiperazin-1-yl)-3-methyl-naphthalene-1,4-dione CAS Name: 2-methyl-3-[4-(phenylmethyl)-1-piperazinyl]naphthalene-1,4-dione IUPAC Name: 2-(4-benzylpiperazin-1-yl)-3-methylnaphthalene-1,4-dione Traditional Name: 2-(4-benzylpiperazino)-3-methyl-1,4-naphthoquinone Formula: C22H22N2O2 MolecularWeight: 346.42228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC=CC=C2C1=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=O)C2=CC=CC=C2C1=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H22N2O2/c1-16-20(22(26)19-10-6-5-9-18(19)21(16)25)24-13-11-23(12-14-24)15-17-7-3-2-4-8-17/h2-10H,11-15H2,1H3