4-(4-methoxypiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: 4-(4-methoxypiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: 4-[(4-methoxy-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: 4-[(4-methoxy-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: 4-(4-methoxypiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [4-(4-methoxypiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C12H17N3O5S MolecularWeight: 315.34548

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

Isomeric SMILES

COC1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O5S/c1-20-9-4-6-14(7-5-9)21(18,19)10-2-3-11(13)12(8-10)15(16)17/h2-3,8-9H,4-7,13H2,1H3