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

Systemtic Name: [4-(4-azanyl-7-methoxy-6-phenyl-quinolin-2-yl)-1,4-diazepan-1-yl]-morpholin-4-yl-methanone Openeye Name: [4-(4-amino-7-methoxy-6-phenyl-2-quinolyl)-1,4-diazepan-1-yl]-morpholino-methanone CAS Name: [4-(4-amino-7-methoxy-6-phenyl-2-quinolinyl)-1,4-diazepan-1-yl]-(4-morpholinyl)methanone IUPAC Name: [4-(4-amino-7-methoxy-6-phenylquinolin-2-yl)-1,4-diazepan-1-yl]-morpholin-4-ylmethanone Traditional Name: [4-(4-amino-7-methoxy-6-phenyl-2-quinolyl)-1,4-diazepan-1-yl]-morpholino-methanone Formula: C26H31N5O3 MolecularWeight: 461.55604

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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

Isomeric SMILES

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

InChI

InChI=1S/C26H31N5O3/c1-33-24-18-23-21(16-20(24)19-6-3-2-4-7-19)22(27)17-25(28-23)29-8-5-9-30(11-10-29)26(32)31-12-14-34-15-13-31/h2-4,6-7,16-18H,5,8-15H2,1H3,(H2,27,28)