azanyl 3-[3-[5-(4-carbamimidoylphenyl)pentanoyl]-4-methoxy-2-oxidanyl-phenyl]propanoate

Systemtic Name: azanyl 3-[3-[5-(4-carbamimidoylphenyl)pentanoyl]-4-methoxy-2-oxidanyl-phenyl]propanoate Openeye Name: amino 3-[3-[5-(4-carbamimidoylphenyl)pentanoyl]-2-hydroxy-4-methoxy-phenyl]propanoate CAS Name: 3-[3-[5-(4-carbamimidoylphenyl)-1-oxopentyl]-2-hydroxy-4-methoxyphenyl]propanoic acid amino ester IUPAC Name: amino 3-[3-[5-(4-carbamimidoylphenyl)pentanoyl]-2-hydroxy-4-methoxyphenyl]propanoate Traditional Name: 3-[3-[5-(4-amidinophenyl)pentanoyl]-2-hydroxy-4-methoxy-phenyl]propionic acid amino ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CCC(=O)ON)O)C(=O)CCCCC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

COC1=C(C(=C(C=C1)CCC(=O)ON)O)C(=O)CCCCC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C22H27N3O5/c1-29-18-12-10-15(11-13-19(27)30-25)21(28)20(18)17(26)5-3-2-4-14-6-8-16(9-7-14)22(23)24/h6-10,12,28H,2-5,11,13,25H2,1H3,(H3,23,24)