2-[3-[(4-carbamimidoylphenyl)amino]-2-carboxyoxy-2-ethanoyl-3-(3-methoxy-4-phenylmethoxy-phenyl)pyrrolidin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[(4-carbamimidoylphenyl)amino]-2-carboxyoxy-2-ethanoyl-3-(3-methoxy-4-phenylmethoxy-phenyl)pyrrolidin-1-yl]ethanoic acid Openeye Name: 2-[2-acetyl-3-(4-benzyloxy-3-methoxy-phenyl)-3-(4-carbamimidoylanilino)-2-carboxyoxy-pyrrolidin-1-yl]acetic acid CAS Name: 2-[2-acetyl-3-(4-carbamimidoylanilino)-2-carboxyoxy-3-(3-methoxy-4-phenylmethoxyphenyl)-1-pyrrolidinyl]acetic acid IUPAC Name: 2-[2-acetyl-3-(4-carbamimidoylanilino)-2-carboxyoxy-3-(3-methoxy-4-phenylmethoxyphenyl)pyrrolidin-1-yl]acetic acid Traditional Name: 2-[2-acetyl-3-(4-amidinoanilino)-3-(4-benzoxy-3-methoxy-phenyl)-2-carboxyoxy-pyrrolidino]acetic acid Formula: C30H32N4O8 MolecularWeight: 576.59708

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C(CCN1CC(=O)O)(C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)NC4=CC=C(C=C4)C(=N)N)OC(=O)O

Isomeric SMILES

CC(=O)C1(C(CCN1CC(=O)O)(C2=CC(=C(C=C2)OCC3=CC=CC=C3)OC)NC4=CC=C(C=C4)C(=N)N)OC(=O)O

InChI

InChI=1S/C30H32N4O8/c1-19(35)30(42-28(38)39)29(14-15-34(30)17-26(36)37,33-23-11-8-21(9-12-23)27(31)32)22-10-13-24(25(16-22)40-2)41-18-20-6-4-3-5-7-20/h3-13,16,33H,14-15,17-18H2,1-2H3,(H3,31,32)(H,36,37)(H,38,39)