1-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-4-prop-2-enyl-quinoxaline-2,3-dione

Systemtic Name: 1-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-4-prop-2-enyl-quinoxaline-2,3-dione Openeye Name: 1-allyl-4-[[4-(azepane-1-carbonyl)phenyl]methyl]quinoxaline-2,3-dione CAS Name: 1-[[4-[1-azepanyl(oxo)methyl]phenyl]methyl]-4-prop-2-enylquinoxaline-2,3-dione IUPAC Name: 1-[[4-(azepane-1-carbonyl)phenyl]methyl]-4-prop-2-enylquinoxaline-2,3-dione Traditional Name: 1-allyl-4-[4-(azepane-1-carbonyl)benzyl]quinoxaline-2,3-quinone Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2N(C(=O)C1=O)CC3=CC=C(C=C3)C(=O)N4CCCCCC4

Isomeric SMILES

C=CCN1C2=CC=CC=C2N(C(=O)C1=O)CC3=CC=C(C=C3)C(=O)N4CCCCCC4

InChI

InChI=1S/C25H27N3O3/c1-2-15-27-21-9-5-6-10-22(21)28(25(31)24(27)30)18-19-11-13-20(14-12-19)23(29)26-16-7-3-4-8-17-26/h2,5-6,9-14H,1,3-4,7-8,15-18H2