[6-methanoyl-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinolin-3-yl]methylcarbamic acid

Systemtic Name: [6-methanoyl-2-(2-methylpropyl)-1-oxidanylidene-4-phenyl-isoquinolin-3-yl]methylcarbamic acid Openeye Name: (6-formyl-2-isobutyl-1-oxo-4-phenyl-3-isoquinolyl)methylcarbamic acid CAS Name: [6-formyl-2-(2-methylpropyl)-1-oxo-4-phenyl-3-isoquinolinyl]methylcarbamic acid IUPAC Name: [6-formyl-2-(2-methylpropyl)-1-oxo-4-phenylisoquinolin-3-yl]methylcarbamic acid Traditional Name: (6-formyl-2-isobutyl-1-keto-4-phenyl-3-isoquinolyl)methylcarbamic acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)C=O)C3=CC=CC=C3)CNC(=O)O

Isomeric SMILES

CC(C)CN1C(=C(C2=C(C1=O)C=CC(=C2)C=O)C3=CC=CC=C3)CNC(=O)O

InChI

InChI=1S/C22H22N2O4/c1-14(2)12-24-19(11-23-22(27)28)20(16-6-4-3-5-7-16)18-10-15(13-25)8-9-17(18)21(24)26/h3-10,13-14,23H,11-12H2,1-2H3,(H,27,28)