3-[2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-2-cyclopentyl-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-2-cyclopentyl-3-oxidanylidene-propanoic acid Openeye Name: 3-[2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]pyrrolidin-1-yl]-2-cyclopentyl-3-oxo-propanoic acid CAS Name: 3-[2-[2-(6-carbamimidoyl-1-ethyl-2-indolyl)ethyl]-1-pyrrolidinyl]-2-cyclopentyl-3-oxopropanoic acid IUPAC Name: 3-[2-[2-(6-carbamimidoyl-1-ethylindol-2-yl)ethyl]pyrrolidin-1-yl]-2-cyclopentyl-3-oxopropanoic acid Traditional Name: 3-[2-[2-(6-amidino-1-ethyl-indol-2-yl)ethyl]pyrrolidino]-2-cyclopentyl-3-keto-propionic acid Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C(C4CCCC4)C(=O)O

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC3CCCN3C(=O)C(C4CCCC4)C(=O)O

InChI

InChI=1S/C25H34N4O3/c1-2-28-20(14-17-9-10-18(23(26)27)15-21(17)28)12-11-19-8-5-13-29(19)24(30)22(25(31)32)16-6-3-4-7-16/h9-10,14-16,19,22H,2-8,11-13H2,1H3,(H3,26,27)(H,31,32)