1-tert-butyl-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea

Systemtic Name: 1-tert-butyl-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Openeye Name: 1-tert-butyl-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea CAS Name: 1-tert-butyl-3-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]urea IUPAC Name: 1-tert-butyl-3-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Traditional Name: 1-tert-butyl-3-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)urea Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC(C)(C)C

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)NC(C)(C)C

InChI

InChI=1S/C17H25N3O2/c1-5-15(21)20-9-8-12-6-7-14(10-13(12)11-20)18-16(22)19-17(2,3)4/h6-7,10H,5,8-9,11H2,1-4H3,(H2,18,19,22)