2-(4-ethylpiperazin-1-yl)sulfonyl-3-piperidin-1-yl-naphthalene-1,4-dione

Systemtic Name: 2-(4-ethylpiperazin-1-yl)sulfonyl-3-piperidin-1-yl-naphthalene-1,4-dione Openeye Name: 2-(4-ethylpiperazin-1-yl)sulfonyl-3-(1-piperidyl)naphthalene-1,4-dione CAS Name: 2-[(4-ethyl-1-piperazinyl)sulfonyl]-3-(1-piperidinyl)naphthalene-1,4-dione IUPAC Name: 2-(4-ethylpiperazin-1-yl)sulfonyl-3-piperidin-1-ylnaphthalene-1,4-dione Traditional Name: 2-(4-ethylpiperazino)sulfonyl-3-piperidino-1,4-naphthoquinone Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)S(=O)(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

Isomeric SMILES

CCN1CCN(CC1)S(=O)(=O)C2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCCC4

InChI

InChI=1S/C21H27N3O4S/c1-2-22-12-14-24(15-13-22)29(27,28)21-18(23-10-6-3-7-11-23)19(25)16-8-4-5-9-17(16)20(21)26/h4-5,8-9H,2-3,6-7,10-15H2,1H3