ethyl 4-[3-[(4-bromophenyl)sulfonylamino]-1,4-bis(oxidanylidene)naphthalen-2-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-[(4-bromophenyl)sulfonylamino]-1,4-bis(oxidanylidene)naphthalen-2-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-[(4-bromophenyl)sulfonylamino]-1,4-dioxo-2-naphthyl]piperazine-1-carboxylate CAS Name: 4-[3-[(4-bromophenyl)sulfonylamino]-1,4-dioxo-2-naphthalenyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[(4-bromophenyl)sulfonylamino]-1,4-dioxonaphthalen-2-yl]piperazine-1-carboxylate Traditional Name: 4-[3-(brosylamino)-1,4-diketo-2-naphthyl]piperazine-1-carboxylic acid ethyl ester Formula: C23H22BrN3O6S MolecularWeight: 548.40628

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H22BrN3O6S/c1-2-33-23(30)27-13-11-26(12-14-27)20-19(21(28)17-5-3-4-6-18(17)22(20)29)25-34(31,32)16-9-7-15(24)8-10-16/h3-10,25H,2,11-14H2,1H3