2-[4-(aziridin-1-yl)butyl]pyrrolo[3,4-g]isoquinoline-4,9-dione

Systemtic Name: 2-[4-(aziridin-1-yl)butyl]pyrrolo[3,4-g]isoquinoline-4,9-dione Openeye Name: 2-[4-(aziridin-1-yl)butyl]pyrrolo[3,4-g]isoquinoline-4,9-dione CAS Name: 2-[4-(1-aziridinyl)butyl]pyrrolo[3,4-g]isoquinoline-4,9-dione IUPAC Name: 2-[4-(aziridin-1-yl)butyl]pyrrolo[3,4-g]isoquinoline-4,9-dione Traditional Name: 2-(4-ethyleniminobutyl)pyrrol[3,4-g]isoquinoline-4,9-quinone Formula: C17H17N3O2 MolecularWeight: 295.33578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN1CCCCN2C=C3C(=C2)C(=O)C4=C(C3=O)C=CN=C4

Isomeric SMILES

C1CN1CCCCN2C=C3C(=C2)C(=O)C4=C(C3=O)C=CN=C4

InChI

InChI=1S/C17H17N3O2/c21-16-12-3-4-18-9-13(12)17(22)15-11-20(10-14(15)16)6-2-1-5-19-7-8-19/h3-4,9-11H,1-2,5-8H2