ethyl 7-[(4-carbamimidoylphenyl)carbonylamino]-2-methyl-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylate

Systemtic Name: ethyl 7-[(4-carbamimidoylphenyl)carbonylamino]-2-methyl-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylate Openeye Name: ethyl 7-[(4-carbamimidoylbenzoyl)amino]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylate CAS Name: 7-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 7-[(4-carbamimidoylbenzoyl)amino]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylate Traditional Name: 7-[(4-amidinobenzoyl)amino]-3-keto-2-methyl-4H-1,4-benzoxazine-2-carboxylic acid ethyl ester Formula: C20H20N4O5 MolecularWeight: 396.3966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(=O)NC2=C(O1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)C

Isomeric SMILES

CCOC(=O)C1(C(=O)NC2=C(O1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)C

InChI

InChI=1S/C20H20N4O5/c1-3-28-19(27)20(2)18(26)24-14-9-8-13(10-15(14)29-20)23-17(25)12-6-4-11(5-7-12)16(21)22/h4-10H,3H2,1-2H3,(H3,21,22)(H,23,25)(H,24,26)