N-[(1-methyl-2-oxidanylidene-quinolin-3-yl)methyl]-N-[[3-(4-methylpiperazin-1-yl)oxan-3-yl]methyl]cycloheptanecarboxamide

Systemtic Name: N-[(1-methyl-2-oxidanylidene-quinolin-3-yl)methyl]-N-[[3-(4-methylpiperazin-1-yl)oxan-3-yl]methyl]cycloheptanecarboxamide Openeye Name: N-[(1-methyl-2-oxo-3-quinolyl)methyl]-N-[[3-(4-methylpiperazin-1-yl)tetrahydropyran-3-yl]methyl]cycloheptanecarboxamide CAS Name: N-[(1-methyl-2-oxo-3-quinolinyl)methyl]-N-[[3-(4-methyl-1-piperazinyl)-3-oxanyl]methyl]cycloheptanecarboxamide IUPAC Name: N-[(1-methyl-2-oxoquinolin-3-yl)methyl]-N-[[3-(4-methylpiperazin-1-yl)oxan-3-yl]methyl]cycloheptanecarboxamide Traditional Name: N-[(2-keto-1-methyl-3-quinolyl)methyl]-N-[[3-(4-methylpiperazino)tetrahydropyran-3-yl]methyl]cycloheptanecarboxamide Formula: C30H44N4O3 MolecularWeight: 508.69536

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2(CCCOC2)CN(CC3=CC4=CC=CC=C4N(C3=O)C)C(=O)C5CCCCCC5

Isomeric SMILES

CN1CCN(CC1)C2(CCCOC2)CN(CC3=CC4=CC=CC=C4N(C3=O)C)C(=O)C5CCCCCC5

InChI

InChI=1S/C30H44N4O3/c1-31-15-17-34(18-16-31)30(14-9-19-37-23-30)22-33(29(36)24-10-5-3-4-6-11-24)21-26-20-25-12-7-8-13-27(25)32(2)28(26)35/h7-8,12-13,20,24H,3-6,9-11,14-19,21-23H2,1-2H3