N3-tert-butyl-N2-(4-chlorophenyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide

Systemtic Name: N3-tert-butyl-N2-(4-chlorophenyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide Openeye Name: N3-tert-butyl-N2-(4-chlorophenyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide CAS Name: N3-tert-butyl-N2-(4-chlorophenyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide IUPAC Name: 3-N-tert-butyl-2-N-(4-chlorophenyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide Traditional Name: N'-tert-butyl-N-(4-chlorophenyl)-3,4-dihydro-1H-isoquinoline-2,3-dicarboxamide Formula: C21H24ClN3O2 MolecularWeight: 385.88716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1CC2=CC=CC=C2CN1C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)NC(=O)C1CC2=CC=CC=C2CN1C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H24ClN3O2/c1-21(2,3)24-19(26)18-12-14-6-4-5-7-15(14)13-25(18)20(27)23-17-10-8-16(22)9-11-17/h4-11,18H,12-13H2,1-3H3,(H,23,27)(H,24,26)