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

Systemtic Name: 2,3-bis(aziridin-1-yl)-5-(2,4-dinitrophenyl)sulfonyl-naphthalene-1,4-dione Openeye Name: 2,3-bis(aziridin-1-yl)-5-(2,4-dinitrophenyl)sulfonyl-naphthalene-1,4-dione CAS Name: 2,3-bis(1-aziridinyl)-5-(2,4-dinitrophenyl)sulfonylnaphthalene-1,4-dione IUPAC Name: 2,3-bis(aziridin-1-yl)-5-(2,4-dinitrophenyl)sulfonylnaphthalene-1,4-dione Traditional Name: 5-(2,4-dinitrophenyl)sulfonyl-2,3-diethylenimino-1,4-naphthoquinone Formula: C20H14N4O8S MolecularWeight: 470.41216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14N4O8S/c25-19-12-2-1-3-15(16(12)20(26)18(22-8-9-22)17(19)21-6-7-21)33(31,32)14-5-4-11(23(27)28)10-13(14)24(29)30/h1-5,10H,6-9H2