N-[2-(4-morpholin-4-ylphenyl)ethyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4-morpholin-4-ylphenyl)ethyl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-(4-morpholinophenyl)ethyl]-3-nitro-benzenesulfonamide CAS Name: N-[2-[4-(4-morpholinyl)phenyl]ethyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(4-morpholin-4-ylphenyl)ethyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-(4-morpholinophenyl)ethyl]-3-nitro-benzenesulfonamide Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)CCNS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O5S/c22-21(23)17-2-1-3-18(14-17)27(24,25)19-9-8-15-4-6-16(7-5-15)20-10-12-26-13-11-20/h1-7,14,19H,8-13H2