ethyl 6-[(4-carbamimidoylphenyl)carbonylamino]-2,4-dimethyl-3-oxidanylidene-1,4-benzoxazine-2-carboxylate

Systemtic Name: ethyl 6-[(4-carbamimidoylphenyl)carbonylamino]-2,4-dimethyl-3-oxidanylidene-1,4-benzoxazine-2-carboxylate Openeye Name: ethyl 6-[(4-carbamimidoylbenzoyl)amino]-2,4-dimethyl-3-oxo-1,4-benzoxazine-2-carboxylate CAS Name: 6-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-2,4-dimethyl-3-oxo-1,4-benzoxazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(4-carbamimidoylbenzoyl)amino]-2,4-dimethyl-3-oxo-1,4-benzoxazine-2-carboxylate Traditional Name: 6-[(4-amidinobenzoyl)amino]-3-keto-2,4-dimethyl-1,4-benzoxazine-2-carboxylic acid ethyl ester Formula: C21H22N4O5 MolecularWeight: 410.42318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O5/c1-4-29-20(28)21(2)19(27)25(3)15-11-14(9-10-16(15)30-21)24-18(26)13-7-5-12(6-8-13)17(22)23/h5-11H,4H2,1-3H3,(H3,22,23)(H,24,26)