N-[3-[[(4-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]-4-chloranyl-phenyl]morpholine-4-carboxamide

Systemtic Name: N-[3-[[(4-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]-4-chloranyl-phenyl]morpholine-4-carboxamide Openeye Name: N-[3-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]-4-chloro-phenyl]morpholine-4-carboxamide CAS Name: N-[3-[[(4-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]-4-chlorophenyl]-4-morpholinecarboxamide IUPAC Name: N-[3-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]-4-chlorophenyl]morpholine-4-carboxamide Traditional Name: N-[3-[[(4-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]-4-chloro-phenyl]morpholine-4-carboxamide Formula: C22H31ClN4O3 MolecularWeight: 434.95954

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N(CC2=C(C=CC(=C2)NC(=O)N3CCOCC3)Cl)C4CCC(CC4)N

Isomeric SMILES

C1CC1C(=O)N(CC2=C(C=CC(=C2)NC(=O)N3CCOCC3)Cl)C4CCC(CC4)N

InChI

InChI=1S/C22H31ClN4O3/c23-20-8-5-18(25-22(29)26-9-11-30-12-10-26)13-16(20)14-27(21(28)15-1-2-15)19-6-3-17(24)4-7-19/h5,8,13,15,17,19H,1-4,6-7,9-12,14,24H2,(H,25,29)