4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-N-(4-propan-2-ylphenyl)benzamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-N-(4-propan-2-ylphenyl)benzamide Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(4-isopropylphenyl)-3-nitro-benzamide CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-N-(4-propan-2-ylphenyl)benzamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-N-(4-propan-2-ylphenyl)benzamide Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-nitro-N-p-cumenyl-benzamide Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCC4=CC=CC=C4C3)[N+](=O)[O-]

InChI

InChI=1S/C25H25N3O3/c1-17(2)18-7-10-22(11-8-18)26-25(29)20-9-12-23(24(15-20)28(30)31)27-14-13-19-5-3-4-6-21(19)16-27/h3-12,15,17H,13-14,16H2,1-2H3,(H,26,29)