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

Systemtic Name: azanyl 3-[2-[5-(4-carbamimidoylphenyl)pentanoyl]-3-methoxy-phenyl]propanoate Openeye Name: amino 3-[2-[5-(4-carbamimidoylphenyl)pentanoyl]-3-methoxy-phenyl]propanoate CAS Name: 3-[2-[5-(4-carbamimidoylphenyl)-1-oxopentyl]-3-methoxyphenyl]propanoic acid amino ester IUPAC Name: amino 3-[2-[5-(4-carbamimidoylphenyl)pentanoyl]-3-methoxyphenyl]propanoate Traditional Name: 3-[2-[5-(4-amidinophenyl)pentanoyl]-3-methoxy-phenyl]propionic acid amino ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1C(=O)CCCCC2=CC=C(C=C2)C(=N)N)CCC(=O)ON

Isomeric SMILES

COC1=CC=CC(=C1C(=O)CCCCC2=CC=C(C=C2)C(=N)N)CCC(=O)ON

InChI

InChI=1S/C22H27N3O4/c1-28-19-8-4-6-16(13-14-20(27)29-25)21(19)18(26)7-3-2-5-15-9-11-17(12-10-15)22(23)24/h4,6,8-12H,2-3,5,7,13-14,25H2,1H3,(H3,23,24)