(4-carbamimidoylphenyl) 4-[(2-ethoxy-2-oxidanylidene-ethyl)-phenyl-carbamoyl]benzoate

Systemtic Name: (4-carbamimidoylphenyl) 4-[(2-ethoxy-2-oxidanylidene-ethyl)-phenyl-carbamoyl]benzoate Openeye Name: (4-carbamimidoylphenyl) 4-[(2-ethoxy-2-oxo-ethyl)-phenyl-carbamoyl]benzoate CAS Name: 4-[(N-(2-ethoxy-2-oxoethyl)anilino)-oxomethyl]benzoic acid (4-carbamimidoylphenyl) ester IUPAC Name: (4-carbamimidoylphenyl) 4-[(2-ethoxy-2-oxoethyl)-phenylcarbamoyl]benzoate Traditional Name: 4-[(2-ethoxy-2-keto-ethyl)-phenyl-carbamoyl]benzoic acid (4-amidinophenyl) ester Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC(=O)CN(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C25H23N3O5/c1-2-32-22(29)16-28(20-6-4-3-5-7-20)24(30)18-8-10-19(11-9-18)25(31)33-21-14-12-17(13-15-21)23(26)27/h3-15H,2,16H2,1H3,(H3,26,27)