3-[[2,6-bis(chloranyl)-4-nitro-phenyl]methyl]isoquinoline

Systemtic Name: 3-[[2,6-bis(chloranyl)-4-nitro-phenyl]methyl]isoquinoline Openeye Name: 3-[(2,6-dichloro-4-nitro-phenyl)methyl]isoquinoline CAS Name: 3-[(2,6-dichloro-4-nitrophenyl)methyl]isoquinoline IUPAC Name: 3-[(2,6-dichloro-4-nitrophenyl)methyl]isoquinoline Traditional Name: 3-(2,6-dichloro-4-nitro-benzyl)isoquinoline Formula: C16H10Cl2N2O2 MolecularWeight: 333.1688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)CC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)CC3=C(C=C(C=C3Cl)[N+](=O)[O-])Cl

InChI

InChI=1S/C16H10Cl2N2O2/c17-15-7-13(20(21)22)8-16(18)14(15)6-12-5-10-3-1-2-4-11(10)9-19-12/h1-5,7-9H,6H2