2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3-nitrophenyl)carbonylamino]-N-propan-2-yl-benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3-nitrophenyl)carbonylamino]-N-propan-2-yl-benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-5-[(3-nitrobenzoyl)amino]benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[[(3-nitrophenyl)-oxomethyl]amino]-N-propan-2-ylbenzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(3-nitrobenzoyl)amino]-N-propan-2-ylbenzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-5-[(3-nitrobenzoyl)amino]benzamide Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N4O4/c1-17(2)27-26(32)23-15-21(28-25(31)19-8-5-9-22(14-19)30(33)34)10-11-24(23)29-13-12-18-6-3-4-7-20(18)16-29/h3-11,14-15,17H,12-13,16H2,1-2H3,(H,27,32)(H,28,31)