2-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro-4H-isoquinoline-1,3-dione

Systemtic Name: 2-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro-4H-isoquinoline-1,3-dione Openeye Name: 2-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro-4H-isoquinoline-1,3-dione CAS Name: 2-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro-4H-isoquinoline-1,3-dione IUPAC Name: 2-[(3-nitrophenyl)methyl]-5,6,7,8-tetrahydro-4H-isoquinoline-1,3-dione Traditional Name: 2-(3-nitrobenzyl)-5,6,7,8-tetrahydro-4H-isoquinoline-1,3-quinone Formula: C16H16N2O4 MolecularWeight: 300.30924

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)CC(=O)N(C2=O)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC2=C(C1)CC(=O)N(C2=O)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H16N2O4/c19-15-9-12-5-1-2-7-14(12)16(20)17(15)10-11-4-3-6-13(8-11)18(21)22/h3-4,6,8H,1-2,5,7,9-10H2