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

Systemtic Name: 7-[(4-carbamimidoylphenyl)carbonylamino]-2-methyl-3-oxidanylidene-4H-1,4-benzoxazine-2-carboxylic acid Openeye Name: 7-[(4-carbamimidoylbenzoyl)amino]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylic acid CAS Name: 7-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylic acid IUPAC Name: 7-[(4-carbamimidoylbenzoyl)amino]-2-methyl-3-oxo-4H-1,4-benzoxazine-2-carboxylic acid Traditional Name: 7-[(4-amidinobenzoyl)amino]-3-keto-2-methyl-4H-1,4-benzoxazine-2-carboxylic acid Formula: C18H16N4O5 MolecularWeight: 368.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NC2=C(O1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)C(=O)O

Isomeric SMILES

CC1(C(=O)NC2=C(O1)C=C(C=C2)NC(=O)C3=CC=C(C=C3)C(=N)N)C(=O)O

InChI

InChI=1S/C18H16N4O5/c1-18(17(25)26)16(24)22-12-7-6-11(8-13(12)27-18)21-15(23)10-4-2-9(3-5-10)14(19)20/h2-8H,1H3,(H3,19,20)(H,21,23)(H,22,24)(H,25,26)