5-(6-carbamimidoyl-1-ethyl-indol-2-yl)-3-methanoyl-2-[2-(oxidanylidenemethylidene)pyrrolidin-1-yl]-2-pyrrolidin-1-yl-pentanoic acid

Systemtic Name: 5-(6-carbamimidoyl-1-ethyl-indol-2-yl)-3-methanoyl-2-[2-(oxidanylidenemethylidene)pyrrolidin-1-yl]-2-pyrrolidin-1-yl-pentanoic acid Openeye Name: 5-(6-carbamimidoyl-1-ethyl-indol-2-yl)-3-formyl-2-[2-(oxomethylene)pyrrolidin-1-yl]-2-pyrrolidin-1-yl-pentanoic acid CAS Name: 5-(6-carbamimidoyl-1-ethyl-2-indolyl)-3-formyl-2-[2-(oxomethylidene)-1-pyrrolidinyl]-2-(1-pyrrolidinyl)pentanoic acid IUPAC Name: 5-(6-carbamimidoyl-1-ethylindol-2-yl)-3-formyl-2-[2-(oxomethylidene)pyrrolidin-1-yl]-2-pyrrolidin-1-ylpentanoic acid Traditional Name: 5-(6-amidino-1-ethyl-indol-2-yl)-3-formyl-2-[2-(ketomethylene)pyrrolidino]-2-pyrrolidino-valeric acid Formula: C26H33N5O4 MolecularWeight: 479.57132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC(C=O)C(C(=O)O)(N3CCCC3)N4CCCC4=C=O

Isomeric SMILES

CCN1C(=CC2=C1C=C(C=C2)C(=N)N)CCC(C=O)C(C(=O)O)(N3CCCC3)N4CCCC4=C=O

InChI

InChI=1S/C26H33N5O4/c1-2-30-21(14-18-7-8-19(24(27)28)15-23(18)30)10-9-20(16-32)26(25(34)35,29-11-3-4-12-29)31-13-5-6-22(31)17-33/h7-8,14-16,20H,2-6,9-13H2,1H3,(H3,27,28)(H,34,35)