N,N-diethyl-4-[6-methoxy-2-[(5-methyl-1H-imidazol-4-yl)methyl]-7-nitro-3,4-dihydro-1H-isoquinolin-1-yl]benzamide

Systemtic Name: N,N-diethyl-4-[6-methoxy-2-[(5-methyl-1H-imidazol-4-yl)methyl]-7-nitro-3,4-dihydro-1H-isoquinolin-1-yl]benzamide Openeye Name: N,N-diethyl-4-[6-methoxy-2-[(5-methyl-1H-imidazol-4-yl)methyl]-7-nitro-3,4-dihydro-1H-isoquinolin-1-yl]benzamide CAS Name: N,N-diethyl-4-[6-methoxy-2-[(5-methyl-1H-imidazol-4-yl)methyl]-7-nitro-3,4-dihydro-1H-isoquinolin-1-yl]benzamide IUPAC Name: N,N-diethyl-4-[6-methoxy-2-[(5-methyl-1H-imidazol-4-yl)methyl]-7-nitro-3,4-dihydro-1H-isoquinolin-1-yl]benzamide Traditional Name: N,N-diethyl-4-[6-methoxy-2-[(5-methyl-1H-imidazol-4-yl)methyl]-7-nitro-3,4-dihydro-1H-isoquinolin-1-yl]benzamide Formula: C26H31N5O4 MolecularWeight: 477.55544

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C2C3=CC(=C(C=C3CCN2CC4=C(NC=N4)C)OC)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C2C3=CC(=C(C=C3CCN2CC4=C(NC=N4)C)OC)[N+](=O)[O-]

InChI

InChI=1S/C26H31N5O4/c1-5-29(6-2)26(32)19-9-7-18(8-10-19)25-21-14-23(31(33)34)24(35-4)13-20(21)11-12-30(25)15-22-17(3)27-16-28-22/h7-10,13-14,16,25H,5-6,11-12,15H2,1-4H3,(H,27,28)