4-azanyl-3-ethyl-1,5-bis(oxidanylidene)-2,3-dihydro-2-benzazepine-4-carboxylate

Systemtic Name: 4-azanyl-3-ethyl-1,5-bis(oxidanylidene)-2,3-dihydro-2-benzazepine-4-carboxylate Openeye Name: 4-amino-3-ethyl-1,5-dioxo-2,3-dihydro-2-benzazepine-4-carboxylate CAS Name: 4-amino-3-ethyl-1,5-dioxo-2,3-dihydro-2-benzazepine-4-carboxylate IUPAC Name: 4-amino-3-ethyl-1,5-dioxo-2,3-dihydro-2-benzazepine-4-carboxylate Traditional Name: 4-amino-3-ethyl-1,5-diketo-2,3-dihydro-2-benzazepine-4-carboxylate Formula: C13H13N2O4- MolecularWeight: 261.25332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(C(=O)C2=CC=CC=C2C(=O)N1)(C(=O)[O-])N

Isomeric SMILES

CCC1C(C(=O)C2=CC=CC=C2C(=O)N1)(C(=O)[O-])N

InChI

InChI=1S/C13H14N2O4/c1-2-9-13(14,12(18)19)10(16)7-5-3-4-6-8(7)11(17)15-9/h3-6,9H,2,14H2,1H3,(H,15,17)(H,18,19)/p-1