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

Systemtic Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-5-oxidanylidene-3-propan-2-yloxy-2H-pyrrol-1-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-3-isopropoxy-5-oxo-2H-pyrrol-1-yl]phenyl]propanoate CAS Name: 3-[4-[4-(4-carbamimidoylphenyl)-5-oxo-3-propan-2-yloxy-2H-pyrrol-1-yl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[4-(4-carbamimidoylphenyl)-5-oxo-3-propan-2-yloxy-2H-pyrrol-1-yl]phenyl]propanoate Traditional Name: 3-[4-[3-(4-amidinophenyl)-4-isopropoxy-2-keto-3-pyrrolin-1-yl]phenyl]propionic acid methyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C(=O)N(C1)C2=CC=C(C=C2)CCC(=O)OC)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)OC1=C(C(=O)N(C1)C2=CC=C(C=C2)CCC(=O)OC)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C24H27N3O4/c1-15(2)31-20-14-27(19-11-4-16(5-12-19)6-13-21(28)30-3)24(29)22(20)17-7-9-18(10-8-17)23(25)26/h4-5,7-12,15H,6,13-14H2,1-3H3,(H3,25,26)