2-(diethylamino)-3-pyrrolidin-1-ylsulfonyl-naphthalene-1,4-dione

Systemtic Name: 2-(diethylamino)-3-pyrrolidin-1-ylsulfonyl-naphthalene-1,4-dione Openeye Name: 2-(diethylamino)-3-pyrrolidin-1-ylsulfonyl-naphthalene-1,4-dione CAS Name: 2-(diethylamino)-3-(1-pyrrolidinylsulfonyl)naphthalene-1,4-dione IUPAC Name: 2-(diethylamino)-3-pyrrolidin-1-ylsulfonylnaphthalene-1,4-dione Traditional Name: 2-(diethylamino)-3-pyrrolidinosulfonyl-1,4-naphthoquinone Formula: C18H22N2O4S MolecularWeight: 362.44328

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCN(CC)C1=C(C(=O)C2=CC=CC=C2C1=O)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H22N2O4S/c1-3-19(4-2)15-16(21)13-9-5-6-10-14(13)17(22)18(15)25(23,24)20-11-7-8-12-20/h5-6,9-10H,3-4,7-8,11-12H2,1-2H3