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

Systemtic Name: N-cyclopropyl-3-[7-[2-[di(propan-2-yl)amino]ethoxy]-1-oxidanylidene-isoquinolin-2-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[7-[2-(diisopropylamino)ethoxy]-1-oxo-2-isoquinolyl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[7-[2-[di(propan-2-yl)amino]ethoxy]-1-oxo-2-isoquinolinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[7-[2-[di(propan-2-yl)amino]ethoxy]-1-oxoisoquinolin-2-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[7-[2-(diisopropylamino)ethoxy]-1-keto-2-isoquinolyl]-4-methyl-benzamide Formula: C28H35N3O3 MolecularWeight: 461.5958

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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(C)C)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H35N3O3/c1-18(2)30(19(3)4)14-15-34-24-11-8-21-12-13-31(28(33)25(21)17-24)26-16-22(7-6-20(26)5)27(32)29-23-9-10-23/h6-8,11-13,16-19,23H,9-10,14-15H2,1-5H3,(H,29,32)