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

Systemtic Name: N-[4-methyl-3-[1-oxidanylidene-7-(2-pyrrolidin-1-ylethoxy)isoquinolin-2-yl]phenyl]-3-pyrrolidin-1-yl-benzamide Openeye Name: N-[4-methyl-3-[1-oxo-7-(2-pyrrolidin-1-ylethoxy)-2-isoquinolyl]phenyl]-3-pyrrolidin-1-yl-benzamide CAS Name: N-[4-methyl-3-[1-oxo-7-[2-(1-pyrrolidinyl)ethoxy]-2-isoquinolinyl]phenyl]-3-(1-pyrrolidinyl)benzamide IUPAC Name: N-[4-methyl-3-[1-oxo-7-(2-pyrrolidin-1-ylethoxy)isoquinolin-2-yl]phenyl]-3-pyrrolidin-1-ylbenzamide Traditional Name: N-[3-[1-keto-7-(2-pyrrolidinoethoxy)-2-isoquinolyl]-4-methyl-phenyl]-3-pyrrolidino-benzamide Formula: C33H36N4O3 MolecularWeight: 536.66394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)N3CCCC3)N4C=CC5=C(C4=O)C=C(C=C5)OCCN6CCCC6

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)N3CCCC3)N4C=CC5=C(C4=O)C=C(C=C5)OCCN6CCCC6

InChI

InChI=1S/C33H36N4O3/c1-24-9-11-27(34-32(38)26-7-6-8-28(21-26)36-16-4-5-17-36)22-31(24)37-18-13-25-10-12-29(23-30(25)33(37)39)40-20-19-35-14-2-3-15-35/h6-13,18,21-23H,2-5,14-17,19-20H2,1H3,(H,34,38)