2-nitro-4-piperidin-1-ylsulfonyl-N-(pyridin-3-ylmethyl)aniline

Systemtic Name: 2-nitro-4-piperidin-1-ylsulfonyl-N-(pyridin-3-ylmethyl)aniline Openeye Name: 2-nitro-4-(1-piperidylsulfonyl)-N-(3-pyridylmethyl)aniline CAS Name: 2-nitro-4-(1-piperidinylsulfonyl)-N-(3-pyridinylmethyl)aniline IUPAC Name: 2-nitro-4-piperidin-1-ylsulfonyl-N-(pyridin-3-ylmethyl)aniline Traditional Name: (2-nitro-4-piperidinosulfonyl-phenyl)-(3-pyridylmethyl)amine Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O4S/c22-21(23)17-11-15(26(24,25)20-9-2-1-3-10-20)6-7-16(17)19-13-14-5-4-8-18-12-14/h4-8,11-12,19H,1-3,9-10,13H2