[6,7-bis(aziridin-1-yl)-5,8-bis(oxidanylidene)naphthalen-1-yl] naphthalene-1-sulfonate

Systemtic Name: [6,7-bis(aziridin-1-yl)-5,8-bis(oxidanylidene)naphthalen-1-yl] naphthalene-1-sulfonate Openeye Name: [6,7-bis(aziridin-1-yl)-5,8-dioxo-1-naphthyl] naphthalene-1-sulfonate CAS Name: 1-naphthalenesulfonic acid [6,7-bis(1-aziridinyl)-5,8-dioxo-1-naphthalenyl] ester IUPAC Name: [6,7-bis(aziridin-1-yl)-5,8-dioxonaphthalen-1-yl] naphthalene-1-sulfonate Traditional Name: naphthalene-1-sulfonic acid (6,7-diethylenimino-5,8-diketo-1-naphthyl) ester Formula: C24H18N2O5S MolecularWeight: 446.47512

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Descriptors Computed from Structure

Canonical SMILES:

C1CN1C2=C(C(=O)C3=C(C2=O)C=CC=C3OS(=O)(=O)C4=CC=CC5=CC=CC=C54)N6CC6

Isomeric SMILES

C1CN1C2=C(C(=O)C3=C(C2=O)C=CC=C3OS(=O)(=O)C4=CC=CC5=CC=CC=C54)N6CC6

InChI

InChI=1S/C24H18N2O5S/c27-23-17-8-4-9-18(20(17)24(28)22(26-13-14-26)21(23)25-11-12-25)31-32(29,30)19-10-3-6-15-5-1-2-7-16(15)19/h1-10H,11-14H2