N-[2-[[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenyl]-4-nitro-benzamide

Systemtic Name: N-[2-[[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenyl]-4-nitro-benzamide Openeye Name: N-[2-[[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenyl]-4-nitro-benzamide CAS Name: N-[2-[[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[2-[[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenyl]-4-nitrobenzamide Traditional Name: N-[2-[[(1S)-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]phenyl]-4-nitro-benzamide Formula: C24H23N3O3 MolecularWeight: 401.45772

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=CC=CC=C2C1CC3=CC=CC=C3NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCC2=CC=CC=C2[C@@H]1CC3=CC=CC=C3NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O3/c1-26-15-14-17-6-2-4-8-21(17)23(26)16-19-7-3-5-9-22(19)25-24(28)18-10-12-20(13-11-18)27(29)30/h2-13,23H,14-16H2,1H3,(H,25,28)/t23-/m0/s1