N-(4-azanylcyclohexyl)-N-[[3-(4-morpholin-4-yl-3-nitro-phenyl)phenyl]methyl]cyclopropanecarboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[[3-(4-morpholin-4-yl-3-nitro-phenyl)phenyl]methyl]cyclopropanecarboxamide Openeye Name: N-(4-aminocyclohexyl)-N-[[3-(4-morpholino-3-nitro-phenyl)phenyl]methyl]cyclopropanecarboxamide CAS Name: N-(4-aminocyclohexyl)-N-[[3-[4-(4-morpholinyl)-3-nitrophenyl]phenyl]methyl]cyclopropanecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-N-[[3-(4-morpholin-4-yl-3-nitrophenyl)phenyl]methyl]cyclopropanecarboxamide Traditional Name: N-(4-aminocyclohexyl)-N-[3-(4-morpholino-3-nitro-phenyl)benzyl]cyclopropanecarboxamide Formula: C27H34N4O4 MolecularWeight: 478.58326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CC2=CC=CC(=C2)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])C5CCC(CC5)N

Isomeric SMILES

C1CC1C(=O)N(CC2=CC=CC(=C2)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-])C5CCC(CC5)N

InChI

InChI=1S/C27H34N4O4/c28-23-7-9-24(10-8-23)30(27(32)20-4-5-20)18-19-2-1-3-21(16-19)22-6-11-25(26(17-22)31(33)34)29-12-14-35-15-13-29/h1-3,6,11,16-17,20,23-24H,4-5,7-10,12-15,18,28H2