(3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-nitrophenyl)pyrrolidine-2,5-dione

Systemtic Name: (3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-nitrophenyl)pyrrolidine-2,5-dione Openeye Name: (3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-nitrophenyl)pyrrolidine-2,5-dione CAS Name: (3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-nitrophenyl)pyrrolidine-2,5-dione IUPAC Name: (3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-nitrophenyl)pyrrolidine-2,5-dione Traditional Name: (3S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-nitrophenyl)pyrrolidine-2,5-quinone Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3CC(=O)N(C3=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)[C@H]3CC(=O)N(C3=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O4/c23-18-11-17(20-10-9-13-5-1-2-6-14(13)12-20)19(24)21(18)15-7-3-4-8-16(15)22(25)26/h1-8,17H,9-12H2/t17-/m0/s1