2-(1-azanylisoquinolin-7-yl)oxy-N-[4-[(2Z)-2-methoxyiminopiperidin-1-yl]phenyl]-4-methyl-pentanamide

Systemtic Name: 2-(1-azanylisoquinolin-7-yl)oxy-N-[4-[(2Z)-2-methoxyiminopiperidin-1-yl]phenyl]-4-methyl-pentanamide Openeye Name: 2-[(1-amino-7-isoquinolyl)oxy]-N-[4-[(2Z)-2-methoxyimino-1-piperidyl]phenyl]-4-methyl-pentanamide CAS Name: 2-[(1-amino-7-isoquinolinyl)oxy]-N-[4-[(2Z)-2-methoxyimino-1-piperidinyl]phenyl]-4-methylpentanamide IUPAC Name: 2-(1-aminoisoquinolin-7-yl)oxy-N-[4-[(2Z)-2-methoxyiminopiperidin-1-yl]phenyl]-4-methylpentanamide Traditional Name: 2-[(1-amino-7-isoquinolyl)oxy]-4-methyl-N-[4-[(2Z)-2-methyloximinopiperidino]phenyl]valeramide Formula: C27H33N5O3 MolecularWeight: 475.58262

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)N2CCCCC2=NOC)OC3=CC4=C(C=C3)C=CN=C4N

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=C(C=C1)N\2CCCC/C2=N/OC)OC3=CC4=C(C=C3)C=CN=C4N

InChI

InChI=1S/C27H33N5O3/c1-18(2)16-24(35-22-12-7-19-13-14-29-26(28)23(19)17-22)27(33)30-20-8-10-21(11-9-20)32-15-5-4-6-25(32)31-34-3/h7-14,17-18,24H,4-6,15-16H2,1-3H3,(H2,28,29)(H,30,33)/b31-25-