2-(2-chloroethyl)-2-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-ium

Systemtic Name: 2-(2-chloroethyl)-2-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-ium Openeye Name: 2-(2-chloroethyl)-2-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-ium CAS Name: 2-(2-chloroethyl)-2-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-ium IUPAC Name: 2-(2-chloroethyl)-2-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-ium Traditional Name: 2-(2-chloroethyl)-2-methyl-7-nitro-3,4-dihydro-1H-isoquinolin-2-ium Formula: C12H16ClN2O2+ MolecularWeight: 255.72064

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC2=C(C1)C=C(C=C2)[N+](=O)[O-])CCCl

Isomeric SMILES

C[N+]1(CCC2=C(C1)C=C(C=C2)[N+](=O)[O-])CCCl

InChI

InChI=1S/C12H16ClN2O2/c1-15(7-5-13)6-4-10-2-3-12(14(16)17)8-11(10)9-15/h2-3,8H,4-7,9H2,1H3/q+1