N-[4-methyl-3-[1-oxidanylidene-7-(2-pyrrolidin-1-ylethoxy)isoquinolin-2-yl]phenyl]-3-(oxan-4-yl)benzamide

Systemtic Name: N-[4-methyl-3-[1-oxidanylidene-7-(2-pyrrolidin-1-ylethoxy)isoquinolin-2-yl]phenyl]-3-(oxan-4-yl)benzamide Openeye Name: N-[4-methyl-3-[1-oxo-7-(2-pyrrolidin-1-ylethoxy)-2-isoquinolyl]phenyl]-3-tetrahydropyran-4-yl-benzamide CAS Name: N-[4-methyl-3-[1-oxo-7-[2-(1-pyrrolidinyl)ethoxy]-2-isoquinolinyl]phenyl]-3-(4-oxanyl)benzamide IUPAC Name: N-[4-methyl-3-[1-oxo-7-(2-pyrrolidin-1-ylethoxy)isoquinolin-2-yl]phenyl]-3-(oxan-4-yl)benzamide Traditional Name: N-[3-[1-keto-7-(2-pyrrolidinoethoxy)-2-isoquinolyl]-4-methyl-phenyl]-3-tetrahydropyran-4-yl-benzamide Formula: C34H37N3O4 MolecularWeight: 551.67528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C3CCOCC3)N4C=CC5=C(C4=O)C=C(C=C5)OCCN6CCCC6

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)C3CCOCC3)N4C=CC5=C(C4=O)C=C(C=C5)OCCN6CCCC6

InChI

InChI=1S/C34H37N3O4/c1-24-7-9-29(35-33(38)28-6-4-5-27(21-28)25-12-18-40-19-13-25)22-32(24)37-16-11-26-8-10-30(23-31(26)34(37)39)41-20-17-36-14-2-3-15-36/h4-11,16,21-23,25H,2-3,12-15,17-20H2,1H3,(H,35,38)