2,3-bis(aziridin-1-yl)-5-(4-nitrophenyl)sulfonyl-naphthalene-1,4-dione

Systemtic Name: 2,3-bis(aziridin-1-yl)-5-(4-nitrophenyl)sulfonyl-naphthalene-1,4-dione Openeye Name: 2,3-bis(aziridin-1-yl)-5-(4-nitrophenyl)sulfonyl-naphthalene-1,4-dione CAS Name: 2,3-bis(1-aziridinyl)-5-(4-nitrophenyl)sulfonylnaphthalene-1,4-dione IUPAC Name: 2,3-bis(aziridin-1-yl)-5-(4-nitrophenyl)sulfonylnaphthalene-1,4-dione Traditional Name: 2,3-diethylenimino-5-nosyl-1,4-naphthoquinone Formula: C20H15N3O6S MolecularWeight: 425.4146

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C2=C(C(=O)C3=C(C2=O)C=CC=C3S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])N5CC5

Isomeric SMILES

C1CN1C2=C(C(=O)C3=C(C2=O)C=CC=C3S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-])N5CC5

InChI

InChI=1S/C20H15N3O6S/c24-19-14-2-1-3-15(30(28,29)13-6-4-12(5-7-13)23(26)27)16(14)20(25)18(22-10-11-22)17(19)21-8-9-21/h1-7H,8-11H2