2-(dipropylamino)-3-(3-methylpiperidin-1-yl)sulfonyl-naphthalene-1,4-dione

Systemtic Name: 2-(dipropylamino)-3-(3-methylpiperidin-1-yl)sulfonyl-naphthalene-1,4-dione Openeye Name: 2-(dipropylamino)-3-[(3-methyl-1-piperidyl)sulfonyl]naphthalene-1,4-dione CAS Name: 2-(dipropylamino)-3-[(3-methyl-1-piperidinyl)sulfonyl]naphthalene-1,4-dione IUPAC Name: 2-(dipropylamino)-3-(3-methylpiperidin-1-yl)sulfonylnaphthalene-1,4-dione Traditional Name: 2-(dipropylamino)-3-(3-methylpiperidino)sulfonyl-1,4-naphthoquinone Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCCC(C3)C

Isomeric SMILES

CCCN(CCC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCCC(C3)C

InChI

InChI=1S/C22H30N2O4S/c1-4-12-23(13-5-2)19-20(25)17-10-6-7-11-18(17)21(26)22(19)29(27,28)24-14-8-9-16(3)15-24/h6-7,10-11,16H,4-5,8-9,12-15H2,1-3H3