4-tert-butyl-N-[2-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[2-[2-(2-ethanoyl-1H-isoquinolin-1-yl)ethanoylamino]phenyl]benzamide Openeye Name: N-[2-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]phenyl]-4-tert-butyl-benzamide CAS Name: N-[2-[[2-(2-acetyl-1H-isoquinolin-1-yl)-1-oxoethyl]amino]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[2-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]phenyl]-4-tert-butylbenzamide Traditional Name: N-[2-[[2-(2-acetyl-1H-isoquinolin-1-yl)acetyl]amino]phenyl]-4-tert-butyl-benzamide Formula: C30H31N3O3 MolecularWeight: 481.58544

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC=CC=C3NC(=O)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC(=O)N1C=CC2=CC=CC=C2C1CC(=O)NC3=CC=CC=C3NC(=O)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C30H31N3O3/c1-20(34)33-18-17-21-9-5-6-10-24(21)27(33)19-28(35)31-25-11-7-8-12-26(25)32-29(36)22-13-15-23(16-14-22)30(2,3)4/h5-18,27H,19H2,1-4H3,(H,31,35)(H,32,36)