methyl (2R)-3-(4-carbamimidoylphenyl)-2-[(2R)-1-(4-phenylphenyl)carbonylpyrrolidin-2-yl]propanoate

Systemtic Name: methyl (2R)-3-(4-carbamimidoylphenyl)-2-[(2R)-1-(4-phenylphenyl)carbonylpyrrolidin-2-yl]propanoate Openeye Name: methyl (2R)-3-(4-carbamimidoylphenyl)-2-[(2R)-1-(4-phenylbenzoyl)pyrrolidin-2-yl]propanoate CAS Name: (2R)-3-(4-carbamimidoylphenyl)-2-[(2R)-1-[oxo-(4-phenylphenyl)methyl]-2-pyrrolidinyl]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(4-carbamimidoylphenyl)-2-[(2R)-1-(4-phenylbenzoyl)pyrrolidin-2-yl]propanoate Traditional Name: (2R)-3-(4-amidinophenyl)-2-[(2R)-1-(4-phenylbenzoyl)pyrrolidin-2-yl]propionic acid methyl ester Formula: C28H29N3O3 MolecularWeight: 455.54816

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)C(=N)N)C2CCCN2C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)[C@H](CC1=CC=C(C=C1)C(=N)N)[C@H]2CCCN2C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H29N3O3/c1-34-28(33)24(18-19-9-11-22(12-10-19)26(29)30)25-8-5-17-31(25)27(32)23-15-13-21(14-16-23)20-6-3-2-4-7-20/h2-4,6-7,9-16,24-25H,5,8,17-18H2,1H3,(H3,29,30)/t24-,25-/m1/s1