N-(2-dimethylaminoethyl)-4-(3-methoxyphenoxy)-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-(3-methoxyphenoxy)-3-nitro-benzenesulfonamide Openeye Name: N-(2-dimethylaminoethyl)-4-(3-methoxyphenoxy)-3-nitro-benzenesulfonamide CAS Name: N-(2-dimethylaminoethyl)-4-(3-methoxyphenoxy)-3-nitrobenzenesulfonamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(3-methoxyphenoxy)-3-nitrobenzenesulfonamide Traditional Name: N-(2-dimethylaminoethyl)-4-(3-methoxyphenoxy)-3-nitro-benzenesulfonamide Formula: C17H21N3O6S MolecularWeight: 395.43014

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC=C2)OC)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCNS(=O)(=O)C1=CC(=C(C=C1)OC2=CC(=CC=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O6S/c1-19(2)10-9-18-27(23,24)15-7-8-17(16(12-15)20(21)22)26-14-6-4-5-13(11-14)25-3/h4-8,11-12,18H,9-10H2,1-3H3