N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethanamide hydrochloride

Systemtic Name: N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethanamide hydrochloride Openeye Name: N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-oxo-4H-1,4-benzoxazin-6-yl)acetamide hydrochloride CAS Name: N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-oxo-4H-1,4-benzoxazin-6-yl)acetamide hydrochloride IUPAC Name: N-[(4-carbamimidoylphenyl)methyl]-2-methoxy-2-(3-oxo-4H-1,4-benzoxazin-6-yl)acetamide hydrochloride Traditional Name: N-(4-amidinobenzyl)-2-(3-keto-4H-1,4-benzoxazin-6-yl)-2-methoxy-acetamide hydrochloride Formula: C19H21ClN4O4 MolecularWeight: 404.84744

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC2=C(C=C1)OCC(=O)N2)C(=O)NCC3=CC=C(C=C3)C(=N)N.Cl

Isomeric SMILES

COC(C1=CC2=C(C=C1)OCC(=O)N2)C(=O)NCC3=CC=C(C=C3)C(=N)N.Cl

InChI

InChI=1S/C19H20N4O4.ClH/c1-26-17(13-6-7-15-14(8-13)23-16(24)10-27-15)19(25)22-9-11-2-4-12(5-3-11)18(20)21;/h2-8,17H,9-10H2,1H3,(H3,20,21)(H,22,25)(H,23,24);1H