[4-(2,3-dimethyl-5-nitro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-yl-methanolate

Systemtic Name: [4-(2,3-dimethyl-5-nitro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-yl-methanolate Openeye Name: [4-(2,3-dimethyl-5-nitro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-yl-methanolate CAS Name: [4-(2,3-dimethyl-5-nitrophenyl)sulfonylimino-1-cyclohexa-2,5-dienylidene]-(1-pyrrolidinyl)methanolate IUPAC Name: [4-(2,3-dimethyl-5-nitrophenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-ylmethanolate Traditional Name: [4-(2,3-dimethyl-5-nitro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidino-methanolate Formula: C19H20N3O5S- MolecularWeight: 402.4442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N=C2C=CC(=C(N3CCCC3)[O-])C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N=C2C=CC(=C(N3CCCC3)[O-])C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O5S/c1-13-11-17(22(24)25)12-18(14(13)2)28(26,27)20-16-7-5-15(6-8-16)19(23)21-9-3-4-10-21/h5-8,11-12,23H,3-4,9-10H2,1-2H3/p-1