5-cyclopropylcarbonyl-2-ethyl-6-(3-nitrophenyl)-4-piperazin-1-ylcarbonyl-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-1,3-dione

Systemtic Name: 5-cyclopropylcarbonyl-2-ethyl-6-(3-nitrophenyl)-4-piperazin-1-ylcarbonyl-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-1,3-dione Openeye Name: 5-(cyclopropanecarbonyl)-2-ethyl-6-(3-nitrophenyl)-4-(piperazine-1-carbonyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-1,3-dione CAS Name: 5-[cyclopropyl(oxo)methyl]-2-ethyl-6-(3-nitrophenyl)-4-[oxo(1-piperazinyl)methyl]-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-1,3-dione IUPAC Name: 5-(cyclopropanecarbonyl)-2-ethyl-6-(3-nitrophenyl)-4-(piperazine-1-carbonyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-1,3-dione Traditional Name: 5-(cyclopropanecarbonyl)-2-ethyl-6-(3-nitrophenyl)-4-(piperazine-1-carbonyl)-3a,4,6,6a-tetrahydropyrrolo[3,4-c]pyrrole-1,3-quinone Formula: C23H27N5O6 MolecularWeight: 469.49038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2C(C1=O)C(N(C2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4CC4)C(=O)N5CCNCC5

Isomeric SMILES

CCN1C(=O)C2C(C1=O)C(N(C2C3=CC(=CC=C3)[N+](=O)[O-])C(=O)C4CC4)C(=O)N5CCNCC5

InChI

InChI=1S/C23H27N5O6/c1-2-26-21(30)16-17(22(26)31)19(23(32)25-10-8-24-9-11-25)27(20(29)13-6-7-13)18(16)14-4-3-5-15(12-14)28(33)34/h3-5,12-13,16-19,24H,2,6-11H2,1H3