ethyl 3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate

Systemtic Name: ethyl 3-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]carbonylpiperidine-1-carboxylate Openeye Name: ethyl 3-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate CAS Name: 3-[[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylate Traditional Name: 3-[4-(3-nitrophenyl)sulfonylpiperazine-1-carbonyl]piperidine-1-carboxylic acid ethyl ester Formula: C19H26N4O7S MolecularWeight: 454.49734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCCC(C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H26N4O7S/c1-2-30-19(25)21-8-4-5-15(14-21)18(24)20-9-11-22(12-10-20)31(28,29)17-7-3-6-16(13-17)23(26)27/h3,6-7,13,15H,2,4-5,8-12,14H2,1H3