N-[(5-chloranyl-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-1-morpholin-4-yl-cyclohexane-1-carboxamide

Systemtic Name: N-[(5-chloranyl-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-1-morpholin-4-yl-cyclohexane-1-carboxamide Openeye Name: N-[[5-chloro-7-(4-pyridyl)-2,3-dihydrobenzofuran-2-yl]methyl]-1-morpholino-cyclohexanecarboxamide CAS Name: N-[(5-chloro-7-pyridin-4-yl-2,3-dihydrobenzofuran-2-yl)methyl]-1-(4-morpholinyl)-1-cyclohexanecarboxamide IUPAC Name: N-[(5-chloro-7-pyridin-4-yl-2,3-dihydro-1-benzofuran-2-yl)methyl]-1-morpholin-4-ylcyclohexane-1-carboxamide Traditional Name: N-[[5-chloro-7-(4-pyridyl)coumaran-2-yl]methyl]-1-morpholino-cyclohexanecarboxamide Formula: C25H30ClN3O3 MolecularWeight: 455.977

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)NCC2CC3=C(O2)C(=CC(=C3)Cl)C4=CC=NC=C4)N5CCOCC5

Isomeric SMILES

C1CCC(CC1)(C(=O)NCC2CC3=C(O2)C(=CC(=C3)Cl)C4=CC=NC=C4)N5CCOCC5

InChI

InChI=1S/C25H30ClN3O3/c26-20-14-19-15-21(32-23(19)22(16-20)18-4-8-27-9-5-18)17-28-24(30)25(6-2-1-3-7-25)29-10-12-31-13-11-29/h4-5,8-9,14,16,21H,1-3,6-7,10-13,15,17H2,(H,28,30)