2-nitro-4-piperidin-1-ylsulfonyl-N-prop-2-ynyl-aniline

Systemtic Name: 2-nitro-4-piperidin-1-ylsulfonyl-N-prop-2-ynyl-aniline Openeye Name: 2-nitro-4-(1-piperidylsulfonyl)-N-prop-2-ynyl-aniline CAS Name: 2-nitro-4-(1-piperidinylsulfonyl)-N-prop-2-ynylaniline IUPAC Name: 2-nitro-4-piperidin-1-ylsulfonyl-N-prop-2-ynylaniline Traditional Name: (2-nitro-4-piperidinosulfonyl-phenyl)-propargyl-amine Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

C#CCNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H17N3O4S/c1-2-8-15-13-7-6-12(11-14(13)17(18)19)22(20,21)16-9-4-3-5-10-16/h1,6-7,11,15H,3-5,8-10H2