methyl 2-[4-[[(E)-3-(4-carbamimidoylphenyl)prop-2-enoyl]amino]phenoxy]ethanoate

Systemtic Name: methyl 2-[4-[[(E)-3-(4-carbamimidoylphenyl)prop-2-enoyl]amino]phenoxy]ethanoate Openeye Name: methyl 2-[4-[[(E)-3-(4-carbamimidoylphenyl)prop-2-enoyl]amino]phenoxy]acetate CAS Name: 2-[4-[[(E)-3-(4-carbamimidoylphenyl)-1-oxoprop-2-enyl]amino]phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[(E)-3-(4-carbamimidoylphenyl)prop-2-enoyl]amino]phenoxy]acetate Traditional Name: 2-[4-[[(E)-3-(4-amidinophenyl)acryloyl]amino]phenoxy]acetic acid methyl ester Formula: C19H19N3O4 MolecularWeight: 353.37186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=CC=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC(=O)COC1=CC=C(C=C1)NC(=O)/C=C/C2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C19H19N3O4/c1-25-18(24)12-26-16-9-7-15(8-10-16)22-17(23)11-4-13-2-5-14(6-3-13)19(20)21/h2-11H,12H2,1H3,(H3,20,21)(H,22,23)/b11-4+