N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-methyl-phenyl]-2-nitro-benzamide

Systemtic Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-methyl-phenyl]-2-nitro-benzamide Openeye Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-methyl-phenyl]-2-nitro-benzamide CAS Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-methylphenyl]-2-nitrobenzamide IUPAC Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-methylphenyl]-2-nitrobenzamide Traditional Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]-2-methyl-phenyl]-2-nitro-benzamide Formula: C27H29N3O5 MolecularWeight: 475.53626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CCN2CCC3=CC(=C(C=C3C2)OC)OC)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)CCN2CCC3=CC(=C(C=C3C2)OC)OC)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C27H29N3O5/c1-18-14-19(8-9-23(18)28-27(31)22-6-4-5-7-24(22)30(32)33)10-12-29-13-11-20-15-25(34-2)26(35-3)16-21(20)17-29/h4-9,14-16H,10-13,17H2,1-3H3,(H,28,31)