2-[5-[3-[(2-carbamimidoylphenyl)amino]prop-1-ynyl]-2-pyrrolidin-1-ylcarbonyl-phenyl]-2-methoxy-ethanoic acid

Systemtic Name: 2-[5-[3-[(2-carbamimidoylphenyl)amino]prop-1-ynyl]-2-pyrrolidin-1-ylcarbonyl-phenyl]-2-methoxy-ethanoic acid Openeye Name: 2-[5-[3-(2-carbamimidoylanilino)prop-1-ynyl]-2-(pyrrolidine-1-carbonyl)phenyl]-2-methoxy-acetic acid CAS Name: 2-[5-[3-(2-carbamimidoylanilino)prop-1-ynyl]-2-[oxo(1-pyrrolidinyl)methyl]phenyl]-2-methoxyacetic acid IUPAC Name: 2-[5-[3-(2-carbamimidoylanilino)prop-1-ynyl]-2-(pyrrolidine-1-carbonyl)phenyl]-2-methoxyacetic acid Traditional Name: 2-[5-[3-(2-amidinoanilino)prop-1-ynyl]-2-(pyrrolidine-1-carbonyl)phenyl]-2-methoxy-acetic acid Formula: C24H26N4O4 MolecularWeight: 434.48764

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=C(C=CC(=C1)C#CCNC2=CC=CC=C2C(=N)N)C(=O)N3CCCC3)C(=O)O

Isomeric SMILES

COC(C1=C(C=CC(=C1)C#CCNC2=CC=CC=C2C(=N)N)C(=O)N3CCCC3)C(=O)O

InChI

InChI=1S/C24H26N4O4/c1-32-21(24(30)31)19-15-16(10-11-17(19)23(29)28-13-4-5-14-28)7-6-12-27-20-9-3-2-8-18(20)22(25)26/h2-3,8-11,15,21,27H,4-5,12-14H2,1H3,(H3,25,26)(H,30,31)