[4-[4-azanyl-5-(furan-2-yl)-6,7-dimethoxy-quinolin-2-yl]-1,4-diazepan-1-yl]-morpholin-4-yl-methanone

Systemtic Name: [4-[4-azanyl-5-(furan-2-yl)-6,7-dimethoxy-quinolin-2-yl]-1,4-diazepan-1-yl]-morpholin-4-yl-methanone Openeye Name: [4-[4-amino-5-(2-furyl)-6,7-dimethoxy-2-quinolyl]-1,4-diazepan-1-yl]-morpholino-methanone CAS Name: [4-[4-amino-5-(2-furanyl)-6,7-dimethoxy-2-quinolinyl]-1,4-diazepan-1-yl]-(4-morpholinyl)methanone IUPAC Name: [4-[4-amino-5-(furan-2-yl)-6,7-dimethoxyquinolin-2-yl]-1,4-diazepan-1-yl]-morpholin-4-ylmethanone Traditional Name: [4-[4-amino-5-(2-furyl)-6,7-dimethoxy-2-quinolyl]-1,4-diazepan-1-yl]-morpholino-methanone Formula: C25H31N5O5 MolecularWeight: 481.54414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=CC(=NC2=C1)N3CCCN(CC3)C(=O)N4CCOCC4)N)C5=CC=CO5)OC

Isomeric SMILES

COC1=C(C(=C2C(=CC(=NC2=C1)N3CCCN(CC3)C(=O)N4CCOCC4)N)C5=CC=CO5)OC

InChI

InChI=1S/C25H31N5O5/c1-32-20-16-18-22(23(24(20)33-2)19-5-3-12-35-19)17(26)15-21(27-18)28-6-4-7-29(9-8-28)25(31)30-10-13-34-14-11-30/h3,5,12,15-16H,4,6-11,13-14H2,1-2H3,(H2,26,27)