tert-butyl N-[[2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-6-pyrrolidin-1-ylcarbonyl-isoquinolin-3-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-6-pyrrolidin-1-ylcarbonyl-isoquinolin-3-yl]methyl]carbamate Openeye Name: tert-butyl N-[[2-isobutyl-1-oxo-4-phenyl-6-(pyrrolidine-1-carbonyl)-3-isoquinolyl]methyl]carbamate CAS Name: N-[[2-(2-methylpropyl)-1-oxo-6-[oxo(1-pyrrolidinyl)methyl]-4-phenyl-3-isoquinolinyl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[2-(2-methylpropyl)-1-oxo-4-phenyl-6-(pyrrolidine-1-carbonyl)isoquinolin-3-yl]methyl]carbamate Traditional Name: N-[[2-isobutyl-1-keto-4-phenyl-6-(pyrrolidine-1-carbonyl)-3-isoquinolyl]methyl]carbamic acid tert-butyl ester Formula: C30H37N3O4 MolecularWeight: 503.63248

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)C(=O)N3CCCC3)C4=CC=CC=C4)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)C(=O)N3CCCC3)C4=CC=CC=C4)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C30H37N3O4/c1-20(2)19-33-25(18-31-29(36)37-30(3,4)5)26(21-11-7-6-8-12-21)24-17-22(13-14-23(24)28(33)35)27(34)32-15-9-10-16-32/h6-8,11-14,17,20H,9-10,15-16,18-19H2,1-5H3,(H,31,36)