ethyl 4-[2-[(4-carbamimidoylphenyl)carbonylamino]-3-prop-2-enoyloxy-phenoxy]butanoate

Systemtic Name: ethyl 4-[2-[(4-carbamimidoylphenyl)carbonylamino]-3-prop-2-enoyloxy-phenoxy]butanoate Openeye Name: ethyl 4-[2-[(4-carbamimidoylbenzoyl)amino]-3-prop-2-enoyloxy-phenoxy]butanoate CAS Name: 4-[2-[[(4-carbamimidoylphenyl)-oxomethyl]amino]-3-(1-oxoprop-2-enoxy)phenoxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-carbamimidoylbenzoyl)amino]-3-prop-2-enoyloxyphenoxy]butanoate Traditional Name: 4-[3-acryloyloxy-2-[(4-amidinobenzoyl)amino]phenoxy]butyric acid ethyl ester Formula: C23H25N3O6 MolecularWeight: 439.4611

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCOC1=CC=CC(=C1NC(=O)C2=CC=C(C=C2)C(=N)N)OC(=O)C=C

Isomeric SMILES

CCOC(=O)CCCOC1=CC=CC(=C1NC(=O)C2=CC=C(C=C2)C(=N)N)OC(=O)C=C

InChI

InChI=1S/C23H25N3O6/c1-3-19(27)32-18-8-5-7-17(31-14-6-9-20(28)30-4-2)21(18)26-23(29)16-12-10-15(11-13-16)22(24)25/h3,5,7-8,10-13H,1,4,6,9,14H2,2H3,(H3,24,25)(H,26,29)