methyl 3-[4-[4-(4-carbamimidoylphenyl)-3-ethoxy-5-oxidanylidene-2H-pyrrol-1-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3-ethoxy-5-oxidanylidene-2H-pyrrol-1-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3-ethoxy-5-oxo-2H-pyrrol-1-yl]phenyl]propanoate CAS Name: 3-[4-[4-(4-carbamimidoylphenyl)-3-ethoxy-5-oxo-2H-pyrrol-1-yl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3-ethoxy-5-oxo-2H-pyrrol-1-yl]phenyl]propanoate Traditional Name: 3-[4-[3-(4-amidinophenyl)-4-ethoxy-2-keto-3-pyrrolin-1-yl]phenyl]propionic acid methyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)N(C1)C2=CC=C(C=C2)CCC(=O)OC)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CCOC1=C(C(=O)N(C1)C2=CC=C(C=C2)CCC(=O)OC)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C23H25N3O4/c1-3-30-19-14-26(18-11-4-15(5-12-18)6-13-20(27)29-2)23(28)21(19)16-7-9-17(10-8-16)22(24)25/h4-5,7-12H,3,6,13-14H2,1-2H3,(H3,24,25)