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

Systemtic Name: [4-(4-azanyl-6,7-dimethoxy-5-phenyl-quinolin-2-yl)-1,4-diazepan-1-yl]-morpholin-4-yl-methanone Openeye Name: [4-(4-amino-6,7-dimethoxy-5-phenyl-2-quinolyl)-1,4-diazepan-1-yl]-morpholino-methanone CAS Name: [4-(4-amino-6,7-dimethoxy-5-phenyl-2-quinolinyl)-1,4-diazepan-1-yl]-(4-morpholinyl)methanone IUPAC Name: [4-(4-amino-6,7-dimethoxy-5-phenylquinolin-2-yl)-1,4-diazepan-1-yl]-morpholin-4-ylmethanone Traditional Name: [4-(4-amino-6,7-dimethoxy-5-phenyl-2-quinolyl)-1,4-diazepan-1-yl]-morpholino-methanone Formula: C27H33N5O4 MolecularWeight: 491.58202

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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=CC=C5)OC

Isomeric SMILES

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

InChI

InChI=1S/C27H33N5O4/c1-34-22-18-21-25(24(26(22)35-2)19-7-4-3-5-8-19)20(28)17-23(29-21)30-9-6-10-31(12-11-30)27(33)32-13-15-36-16-14-32/h3-5,7-8,17-18H,6,9-16H2,1-2H3,(H2,28,29)