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

Systemtic Name: methyl N-(4-azanylcyclohexyl)-N-[[3-(4-morpholin-4-yl-3-nitro-phenyl)phenyl]methyl]carbamate Openeye Name: methyl N-(4-aminocyclohexyl)-N-[[3-(4-morpholino-3-nitro-phenyl)phenyl]methyl]carbamate CAS Name: N-(4-aminocyclohexyl)-N-[[3-[4-(4-morpholinyl)-3-nitrophenyl]phenyl]methyl]carbamic acid methyl ester IUPAC Name: methyl N-(4-aminocyclohexyl)-N-[[3-(4-morpholin-4-yl-3-nitrophenyl)phenyl]methyl]carbamate Traditional Name: N-(4-aminocyclohexyl)-N-[3-(4-morpholino-3-nitro-phenyl)benzyl]carbamic acid methyl ester Formula: C25H32N4O5 MolecularWeight: 468.54538

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N(CC1=CC=CC(=C1)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C4CCC(CC4)N

Isomeric SMILES

COC(=O)N(CC1=CC=CC(=C1)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-])C4CCC(CC4)N

InChI

InChI=1S/C25H32N4O5/c1-33-25(30)28(22-8-6-21(26)7-9-22)17-18-3-2-4-19(15-18)20-5-10-23(24(16-20)29(31)32)27-11-13-34-14-12-27/h2-5,10,15-16,21-22H,6-9,11-14,17,26H2,1H3