methyl 3-[4-[1-(4-carbamimidoylphenyl)pyrrolidin-3-yl]phenyl]propanoate

Systemtic Name: methyl 3-[4-[1-(4-carbamimidoylphenyl)pyrrolidin-3-yl]phenyl]propanoate Openeye Name: methyl 3-[4-[1-(4-carbamimidoylphenyl)pyrrolidin-3-yl]phenyl]propanoate CAS Name: 3-[4-[1-(4-carbamimidoylphenyl)-3-pyrrolidinyl]phenyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[1-(4-carbamimidoylphenyl)pyrrolidin-3-yl]phenyl]propanoate Traditional Name: 3-[4-[1-(4-amidinophenyl)pyrrolidin-3-yl]phenyl]propionic acid methyl ester Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CC=C(C=C1)C2CCN(C2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

COC(=O)CCC1=CC=C(C=C1)C2CCN(C2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C21H25N3O2/c1-26-20(25)11-4-15-2-5-16(6-3-15)18-12-13-24(14-18)19-9-7-17(8-10-19)21(22)23/h2-3,5-10,18H,4,11-14H2,1H3,(H3,22,23)