2-[(3-methoxyphenyl)methoxy]-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(3-methoxyphenyl)methoxy]-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 2-[(3-methoxyphenyl)methoxy]-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 2-[(3-methoxyphenyl)methoxy]-1-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 2-[(3-methoxyphenyl)methoxy]-1-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 2-m-anisyloxy-1-[4-(3-nitrophenyl)sulfonylpiperazino]ethanone Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O7S/c1-29-18-6-2-4-16(12-18)14-30-15-20(24)21-8-10-22(11-9-21)31(27,28)19-7-3-5-17(13-19)23(25)26/h2-7,12-13H,8-11,14-15H2,1H3