(4-carbamimidoylphenyl) 4-[3-[(2-ethoxy-2-oxidanylidene-ethyl)-prop-2-enyl-amino]-3-oxidanylidene-propyl]benzoate

Systemtic Name: (4-carbamimidoylphenyl) 4-[3-[(2-ethoxy-2-oxidanylidene-ethyl)-prop-2-enyl-amino]-3-oxidanylidene-propyl]benzoate Openeye Name: (4-carbamimidoylphenyl) 4-[3-[allyl-(2-ethoxy-2-oxo-ethyl)amino]-3-oxo-propyl]benzoate CAS Name: 4-[3-[(2-ethoxy-2-oxoethyl)-prop-2-enylamino]-3-oxopropyl]benzoic acid (4-carbamimidoylphenyl) ester IUPAC Name: (4-carbamimidoylphenyl) 4-[3-[(2-ethoxy-2-oxoethyl)-prop-2-enylamino]-3-oxopropyl]benzoate Traditional Name: 4-[3-[allyl-(2-ethoxy-2-keto-ethyl)amino]-3-keto-propyl]benzoic acid (4-amidinophenyl) ester Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN(CC=C)C(=O)CCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CCOC(=O)CN(CC=C)C(=O)CCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C24H27N3O5/c1-3-15-27(16-22(29)31-4-2)21(28)14-7-17-5-8-19(9-6-17)24(30)32-20-12-10-18(11-13-20)23(25)26/h3,5-6,8-13H,1,4,7,14-16H2,2H3,(H3,25,26)