3-methyl-N-[4-[(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)amino]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[(2-morpholin-4-ylsulfonyl-4-nitro-phenyl)amino]phenyl]butanamide Openeye Name: 3-methyl-N-[4-(2-morpholinosulfonyl-4-nitro-anilino)phenyl]butanamide CAS Name: 3-methyl-N-[4-[2-(4-morpholinylsulfonyl)-4-nitroanilino]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-(2-morpholin-4-ylsulfonyl-4-nitroanilino)phenyl]butanamide Traditional Name: 3-methyl-N-[4-(2-morpholinosulfonyl-4-nitro-anilino)phenyl]butyramide Formula: C21H26N4O6S MolecularWeight: 462.51934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H26N4O6S/c1-15(2)13-21(26)23-17-5-3-16(4-6-17)22-19-8-7-18(25(27)28)14-20(19)32(29,30)24-9-11-31-12-10-24/h3-8,14-15,22H,9-13H2,1-2H3,(H,23,26)