2-[(4-chloranyl-3-nitro-phenyl)methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[(4-chloranyl-3-nitro-phenyl)methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[(4-chloro-3-nitro-phenyl)methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[(4-chloro-3-nitrophenyl)methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[(4-chloro-3-nitrophenyl)methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(4-chloro-3-nitro-benzyl)-3,4-dihydro-1H-isoquinoline Formula: C16H15ClN2O2 MolecularWeight: 302.7555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN2O2/c17-15-6-5-12(9-16(15)19(20)21)10-18-8-7-13-3-1-2-4-14(13)11-18/h1-6,9H,7-8,10-11H2