N-[[(2S)-2-methylcyclohexylidene]amino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[[(2S)-2-methylcyclohexylidene]amino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[[(2S)-2-methylcyclohexylidene]amino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[[(2S)-2-methylcyclohexylidene]amino]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[[(2S)-2-methylcyclohexylidene]amino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [[(2S)-2-methylcyclohexylidene]amino]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C17H24N4O4S MolecularWeight: 380.46186

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1=NNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

C[C@H]1CCCCC1=NNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C17H24N4O4S/c1-13-6-2-3-7-15(13)18-19-16-9-8-14(12-17(16)21(22)23)26(24,25)20-10-4-5-11-20/h8-9,12-13,19H,2-7,10-11H2,1H3/t13-/m0/s1