ethyl 5-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 5-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-1H-indole-2-carboxylate Openeye Name: ethyl 5-[4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]-1H-indole-2-carboxylate CAS Name: 5-[[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]-1H-indole-2-carboxylate Traditional Name: 5-(4-nosylpiperazine-1-carbonyl)-1H-indole-2-carboxylic acid ethyl ester Formula: C22H22N4O7S MolecularWeight: 486.49768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(N1)C=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC2=C(N1)C=CC(=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O7S/c1-2-33-22(28)20-14-16-13-15(3-8-19(16)23-20)21(27)24-9-11-25(12-10-24)34(31,32)18-6-4-17(5-7-18)26(29)30/h3-8,13-14,23H,2,9-12H2,1H3