N-[(Z)-5-methylhexan-2-ylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(Z)-5-methylhexan-2-ylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(Z)-1,4-dimethylpentylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[(Z)-5-methylhexan-2-ylideneamino]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(Z)-5-methylhexan-2-ylideneamino]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: [(Z)-1,4-dimethylpentylideneamino]-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C17H26N4O4S MolecularWeight: 382.47774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=NNC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])C

Isomeric SMILES

CC(C)CC/C(=N\NC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-])/C

InChI

InChI=1S/C17H26N4O4S/c1-13(2)6-7-14(3)18-19-16-9-8-15(12-17(16)21(22)23)26(24,25)20-10-4-5-11-20/h8-9,12-13,19H,4-7,10-11H2,1-3H3/b18-14-