3-[7-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-1-oxidanylidene-isoquinolin-2-yl]-N-cyclopropyl-4-methyl-benzamide

Systemtic Name: 3-[7-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-1-oxidanylidene-isoquinolin-2-yl]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[7-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-1-oxo-2-isoquinolyl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[7-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-1-oxo-2-isoquinolinyl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[7-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-1-oxoisoquinolin-2-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[7-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-1-keto-2-isoquinolyl]-N-cyclopropyl-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)OCCN(C)CC5CCC5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=CC4=C(C3=O)C=C(C=C4)OCCN(C)CC5CCC5

InChI

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