[4-(3-methoxyphenyl)piperazin-1-yl]-[(3S)-1-(3-nitrophenyl)sulfonylpiperidin-3-yl]methanone

Systemtic Name: [4-(3-methoxyphenyl)piperazin-1-yl]-[(3S)-1-(3-nitrophenyl)sulfonylpiperidin-3-yl]methanone Openeye Name: [4-(3-methoxyphenyl)piperazin-1-yl]-[(3S)-1-(3-nitrophenyl)sulfonyl-3-piperidyl]methanone CAS Name: [4-(3-methoxyphenyl)-1-piperazinyl]-[(3S)-1-(3-nitrophenyl)sulfonyl-3-piperidinyl]methanone IUPAC Name: [4-(3-methoxyphenyl)piperazin-1-yl]-[(3S)-1-(3-nitrophenyl)sulfonylpiperidin-3-yl]methanone Traditional Name: [4-(3-methoxyphenyl)piperazino]-[(3S)-1-(3-nitrophenyl)sulfonyl-3-piperidyl]methanone Formula: C23H28N4O6S MolecularWeight: 488.55662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)[C@H]3CCCN(C3)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O6S/c1-33-21-8-2-6-19(15-21)24-11-13-25(14-12-24)23(28)18-5-4-10-26(17-18)34(31,32)22-9-3-7-20(16-22)27(29)30/h2-3,6-9,15-16,18H,4-5,10-14,17H2,1H3/t18-/m0/s1