N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)-3-[(2-nitrophenyl)amino]propanamide

Systemtic Name: N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)-3-[(2-nitrophenyl)amino]propanamide Openeye Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-3-(2-nitroanilino)propanamide CAS Name: N-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyphenyl]-3-(2-nitroanilino)propanamide IUPAC Name: N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyphenyl)-3-(2-nitroanilino)propanamide Traditional Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-3-(2-nitroanilino)propionamide Formula: C22H28N4O7S MolecularWeight: 492.54532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CCNC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O7S/c1-16(2)33-21-8-7-17(34(30,31)25-11-13-32-14-12-25)15-19(21)24-22(27)9-10-23-18-5-3-4-6-20(18)26(28)29/h3-8,15-16,23H,9-14H2,1-2H3,(H,24,27)