2-[3,7-bis(oxidanylidene)-1-prop-2-enyl-1,2-diazepan-4-yl]isoindole-1,3-dione

Systemtic Name: 2-[3,7-bis(oxidanylidene)-1-prop-2-enyl-1,2-diazepan-4-yl]isoindole-1,3-dione Openeye Name: 2-(1-allyl-3,7-dioxo-diazepan-4-yl)isoindoline-1,3-dione CAS Name: 2-(3,7-dioxo-1-prop-2-enyl-4-diazepanyl)isoindole-1,3-dione IUPAC Name: 2-(3,7-dioxo-1-prop-2-enyldiazepan-4-yl)isoindole-1,3-dione Traditional Name: 2-(1-allyl-3,7-diketo-diazepan-4-yl)isoindoline-1,3-quinone Formula: C16H15N3O4 MolecularWeight: 313.308

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)CCC(C(=O)N1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C=CCN1C(=O)CCC(C(=O)N1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H15N3O4/c1-2-9-18-13(20)8-7-12(14(21)17-18)19-15(22)10-5-3-4-6-11(10)16(19)23/h2-6,12H,1,7-9H2,(H,17,21)