N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3-methyl-5-nitro-imidazol-4-amine

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3-methyl-5-nitro-imidazol-4-amine Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-3-methyl-5-nitro-imidazol-4-amine CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-3-methyl-5-nitro-4-imidazolamine IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methylpropyl]-3-methyl-5-nitroimidazol-4-amine Traditional Name: [2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-methyl-propyl]-(3-methyl-5-nitro-imidazol-4-yl)amine Formula: C17H23N5O2 MolecularWeight: 329.39682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=C(N=CN1C)[N+](=O)[O-])N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)(CNC1=C(N=CN1C)[N+](=O)[O-])N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H23N5O2/c1-17(2,11-18-15-16(22(23)24)19-12-20(15)3)21-9-8-13-6-4-5-7-14(13)10-21/h4-7,12,18H,8-11H2,1-3H3