2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitro-aniline

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitro-aniline Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitro-aniline CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitroaniline IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-methyl-5-nitroaniline Traditional Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phenyl]-methyl-amine Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC(=C1)[N+](=O)[O-])N2CCC3=CC=CC=C3C2

Isomeric SMILES

CNC1=C(C=CC(=C1)[N+](=O)[O-])N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C16H17N3O2/c1-17-15-10-14(19(20)21)6-7-16(15)18-9-8-12-4-2-3-5-13(12)11-18/h2-7,10,17H,8-9,11H2,1H3