ethyl (E)-7-azanyl-7-oxidanylidene-4-(quinoxalin-2-ylcarbonylamino)hept-2-enoate

Systemtic Name: ethyl (E)-7-azanyl-7-oxidanylidene-4-(quinoxalin-2-ylcarbonylamino)hept-2-enoate Openeye Name: ethyl (E)-7-amino-7-oxo-4-(quinoxaline-2-carbonylamino)hept-2-enoate CAS Name: (E)-7-amino-7-oxo-4-[[oxo(2-quinoxalinyl)methyl]amino]-2-heptenoic acid ethyl ester IUPAC Name: ethyl (E)-7-amino-7-oxo-4-(quinoxaline-2-carbonylamino)hept-2-enoate Traditional Name: (E)-7-amino-7-keto-4-(quinoxaline-2-carbonylamino)hept-2-enoic acid ethyl ester Formula: C18H20N4O4 MolecularWeight: 356.3758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC(CCC(=O)N)NC(=O)C1=NC2=CC=CC=C2N=C1

Isomeric SMILES

CCOC(=O)/C=C/C(CCC(=O)N)NC(=O)C1=NC2=CC=CC=C2N=C1

InChI

InChI=1S/C18H20N4O4/c1-2-26-17(24)10-8-12(7-9-16(19)23)21-18(25)15-11-20-13-5-3-4-6-14(13)22-15/h3-6,8,10-12H,2,7,9H2,1H3,(H2,19,23)(H,21,25)/b10-8+