ethyl 5-[7-[(4-carbamimidoylphenyl)carbonylamino]-3-oxidanylidene-1,4-benzoxazin-4-yl]pentanoate

Systemtic Name: ethyl 5-[7-[(4-carbamimidoylphenyl)carbonylamino]-3-oxidanylidene-1,4-benzoxazin-4-yl]pentanoate Openeye Name: ethyl 5-[7-[(4-carbamimidoylbenzoyl)amino]-3-oxo-1,4-benzoxazin-4-yl]pentanoate CAS Name: 5-[7-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-3-oxo-1,4-benzoxazin-4-yl]pentanoic acid ethyl ester IUPAC Name: ethyl 5-[7-[(4-carbamimidoylbenzoyl)amino]-3-oxo-1,4-benzoxazin-4-yl]pentanoate Traditional Name: 5-[7-[(4-amidinobenzoyl)amino]-3-keto-1,4-benzoxazin-4-yl]valeric acid ethyl ester Formula: C23H26N4O5 MolecularWeight: 438.47634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCN1C(=O)COC2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC(=O)CCCCN1C(=O)COC2=C1C=CC(=C2)NC(=O)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H26N4O5/c1-2-31-21(29)5-3-4-12-27-18-11-10-17(13-19(18)32-14-20(27)28)26-23(30)16-8-6-15(7-9-16)22(24)25/h6-11,13H,2-5,12,14H2,1H3,(H3,24,25)(H,26,30)