N-cyclopropyl-3-[7-[2-[(2S)-2-(2-methoxyethyl)pyrrolidin-1-yl]ethoxy]-1-oxidanylidene-isoquinolin-2-yl]-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[7-[2-[(2S)-2-(2-methoxyethyl)pyrrolidin-1-yl]ethoxy]-1-oxidanylidene-isoquinolin-2-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[7-[2-[(2S)-2-(2-methoxyethyl)pyrrolidin-1-yl]ethoxy]-1-oxo-2-isoquinolyl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[7-[2-[(2S)-2-(2-methoxyethyl)-1-pyrrolidinyl]ethoxy]-1-oxo-2-isoquinolinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[7-[2-[(2S)-2-(2-methoxyethyl)pyrrolidin-1-yl]ethoxy]-1-oxoisoquinolin-2-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[1-keto-7-[2-[(2S)-2-(2-methoxyethyl)pyrrolidino]ethoxy]-2-isoquinolyl]-4-methyl-benzamide Formula: C29H35N3O4 MolecularWeight: 489.6059

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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)OCCN5CCCC5CCOC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2CC2)N3C=CC4=C(C3=O)C=C(C=C4)OCCN5CCC[C@H]5CCOC

InChI

InChI=1S/C29H35N3O4/c1-20-5-6-22(28(33)30-23-8-9-23)18-27(20)32-14-11-21-7-10-25(19-26(21)29(32)34)36-17-15-31-13-3-4-24(31)12-16-35-2/h5-7,10-11,14,18-19,23-24H,3-4,8-9,12-13,15-17H2,1-2H3,(H,30,33)/t24-/m0/s1