4-methoxy-2-[1-(4-morpholin-4-ylcarbonyl-1,4-diazepan-1-yl)ethylideneamino]-5-oxidanyl-benzenecarbonitrile

Systemtic Name: 4-methoxy-2-[1-(4-morpholin-4-ylcarbonyl-1,4-diazepan-1-yl)ethylideneamino]-5-oxidanyl-benzenecarbonitrile Openeye Name: 5-hydroxy-4-methoxy-2-[1-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]ethylideneamino]benzonitrile CAS Name: 5-hydroxy-4-methoxy-2-[1-[4-[4-morpholinyl(oxo)methyl]-1,4-diazepan-1-yl]ethylideneamino]benzonitrile IUPAC Name: 5-hydroxy-4-methoxy-2-[1-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]ethylideneamino]benzonitrile Traditional Name: 5-hydroxy-4-methoxy-2-[1-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]ethylideneamino]benzonitrile Formula: C20H27N5O4 MolecularWeight: 401.45948

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=CC(=C(C=C1C#N)O)OC)N2CCCN(CC2)C(=O)N3CCOCC3

Isomeric SMILES

CC(=NC1=CC(=C(C=C1C#N)O)OC)N2CCCN(CC2)C(=O)N3CCOCC3

InChI

InChI=1S/C20H27N5O4/c1-15(22-17-13-19(28-2)18(26)12-16(17)14-21)23-4-3-5-24(7-6-23)20(27)25-8-10-29-11-9-25/h12-13,26H,3-11H2,1-2H3