N-cyclopropyl-4-methyl-3-[1-oxidanylidene-7-(3-piperidin-1-ylpropoxy)isoquinolin-2-yl]benzamide

Systemtic Name: N-cyclopropyl-4-methyl-3-[1-oxidanylidene-7-(3-piperidin-1-ylpropoxy)isoquinolin-2-yl]benzamide Openeye Name: N-cyclopropyl-4-methyl-3-[1-oxo-7-[3-(1-piperidyl)propoxy]-2-isoquinolyl]benzamide CAS Name: N-cyclopropyl-4-methyl-3-[1-oxo-7-[3-(1-piperidinyl)propoxy]-2-isoquinolinyl]benzamide IUPAC Name: N-cyclopropyl-4-methyl-3-[1-oxo-7-(3-piperidin-1-ylpropoxy)isoquinolin-2-yl]benzamide Traditional Name: N-cyclopropyl-3-[1-keto-7-(3-piperidinopropoxy)-2-isoquinolyl]-4-methyl-benzamide Formula: C28H33N3O3 MolecularWeight: 459.57992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=CC4=C(C3=O)C=C(C=C4)OCCCN5CCCCC5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=CC4=C(C3=O)C=C(C=C4)OCCCN5CCCCC5

InChI

InChI=1S/C28H33N3O3/c1-20-6-7-22(27(32)29-23-9-10-23)18-26(20)31-16-12-21-8-11-24(19-25(21)28(31)33)34-17-5-15-30-13-3-2-4-14-30/h6-8,11-12,16,18-19,23H,2-5,9-10,13-15,17H2,1H3,(H,29,32)