[(3-methoxy-4-phenylmethoxy-phenyl)methyl-methyl-amino]-(6-methylsulfonyliminocyclohexa-2,4-dien-1-ylidene)methanolate

Systemtic Name: [(3-methoxy-4-phenylmethoxy-phenyl)methyl-methyl-amino]-(6-methylsulfonyliminocyclohexa-2,4-dien-1-ylidene)methanolate Openeye Name: [(4-benzyloxy-3-methoxy-phenyl)methyl-methyl-amino]-(6-methylsulfonyliminocyclohexa-2,4-dien-1-ylidene)methanolate CAS Name: [(3-methoxy-4-phenylmethoxyphenyl)methyl-methylamino]-(6-methylsulfonylimino-1-cyclohexa-2,4-dienylidene)methanolate IUPAC Name: [(3-methoxy-4-phenylmethoxyphenyl)methyl-methylamino]-(6-methylsulfonyliminocyclohexa-2,4-dien-1-ylidene)methanolate Traditional Name: [(4-benzoxy-3-methoxy-benzyl)-methyl-amino]-(6-mesyliminocyclohexa-2,4-dien-1-ylidene)methanolate Formula: C24H25N2O5S- MolecularWeight: 453.5307

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C(=C3C=CC=CC3=NS(=O)(=O)C)[O-]

Isomeric SMILES

CN(CC1=CC(=C(C=C1)OCC2=CC=CC=C2)OC)C(=C3C=CC=CC3=NS(=O)(=O)C)[O-]

InChI

InChI=1S/C24H26N2O5S/c1-26(24(27)20-11-7-8-12-21(20)25-32(3,28)29)16-19-13-14-22(23(15-19)30-2)31-17-18-9-5-4-6-10-18/h4-15,27H,16-17H2,1-3H3/p-1