2-methoxy-5-[(E)-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinylidene]methyl]phenol

Systemtic Name: 2-methoxy-5-[(E)-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinylidene]methyl]phenol Openeye Name: 2-methoxy-5-[(E)-[(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazono]methyl]phenol CAS Name: 2-methoxy-5-[(E)-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]hydrazinylidene]methyl]phenol IUPAC Name: 2-methoxy-5-[(E)-[(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)hydrazinylidene]methyl]phenol Traditional Name: 2-methoxy-5-[(E)-[(2-nitro-4-pyrrolidinosulfonyl-phenyl)hydrazono]methyl]phenol Formula: C18H20N4O6S MolecularWeight: 420.4396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])O

InChI

InChI=1S/C18H20N4O6S/c1-28-18-7-4-13(10-17(18)23)12-19-20-15-6-5-14(11-16(15)22(24)25)29(26,27)21-8-2-3-9-21/h4-7,10-12,20,23H,2-3,8-9H2,1H3/b19-12+