2-[2-[2-(6-carbamimidoyl-1-methyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[2-[2-(6-carbamimidoyl-1-methyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-2-phenyl-ethanoic acid Openeye Name: 2-[2-[2-(6-carbamimidoyl-1-methyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-2-phenyl-acetic acid CAS Name: 2-[2-[2-(6-carbamimidoyl-1-methyl-2-indolyl)ethyl]-1-pyrrolidinyl]-2-phenylacetic acid IUPAC Name: 2-[2-[2-(6-carbamimidoyl-1-methylindol-2-yl)ethyl]pyrrolidin-1-yl]-2-phenylacetic acid Traditional Name: 2-[2-[2-(6-amidino-1-methyl-indol-2-yl)ethyl]pyrrolidino]-2-phenyl-acetic acid Formula: C24H28N4O2 MolecularWeight: 404.50472

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(C4=CC=CC=C4)C(=O)O

Isomeric SMILES

CN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C24H28N4O2/c1-27-20(14-17-9-10-18(23(25)26)15-21(17)27)12-11-19-8-5-13-28(19)22(24(29)30)16-6-3-2-4-7-16/h2-4,6-7,9-10,14-15,19,22H,5,8,11-13H2,1H3,(H3,25,26)(H,29,30)