2-methyl-7-nitro-1-(3-nitrophenyl)-3,4-dihydroisoquinolin-1-ol

Systemtic Name: 2-methyl-7-nitro-1-(3-nitrophenyl)-3,4-dihydroisoquinolin-1-ol Openeye Name: 2-methyl-7-nitro-1-(3-nitrophenyl)-3,4-dihydroisoquinolin-1-ol CAS Name: 2-methyl-7-nitro-1-(3-nitrophenyl)-3,4-dihydroisoquinolin-1-ol IUPAC Name: 2-methyl-7-nitro-1-(3-nitrophenyl)-3,4-dihydroisoquinolin-1-ol Traditional Name: 2-methyl-7-nitro-1-(3-nitrophenyl)-3,4-dihydroisocarbostyril Formula: C16H15N3O5 MolecularWeight: 329.3074

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1(C3=CC(=CC=C3)[N+](=O)[O-])O)C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1CCC2=C(C1(C3=CC(=CC=C3)[N+](=O)[O-])O)C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15N3O5/c1-17-8-7-11-5-6-14(19(23)24)10-15(11)16(17,20)12-3-2-4-13(9-12)18(21)22/h2-6,9-10,20H,7-8H2,1H3