[4-(6-carbamimidoyl-1-ethyl-indol-2-yl)-1-carboxyoxy-1-[2-(oxidanylidenemethylidene)pyrrolidin-1-yl]-1-pyrrolidin-1-yl-butan-2-yl] hydrogen carbonate

Systemtic Name: [4-(6-carbamimidoyl-1-ethyl-indol-2-yl)-1-carboxyoxy-1-[2-(oxidanylidenemethylidene)pyrrolidin-1-yl]-1-pyrrolidin-1-yl-butan-2-yl] hydrogen carbonate Openeye Name: [4-(6-carbamimidoyl-1-ethyl-indol-2-yl)-2-carboxyoxy-1-[2-(oxomethylene)pyrrolidin-1-yl]-1-pyrrolidin-1-yl-butyl] hydrogen carbonate CAS Name: carbonic acid [4-(6-carbamimidoyl-1-ethyl-2-indolyl)-1-carboxyoxy-1-[2-(oxomethylidene)-1-pyrrolidinyl]-1-(1-pyrrolidinyl)butan-2-yl] ester IUPAC Name: [4-(6-carbamimidoyl-1-ethylindol-2-yl)-1-carboxyoxy-1-[2-(oxomethylidene)pyrrolidin-1-yl]-1-pyrrolidin-1-ylbutan-2-yl] hydrogen carbonate Traditional Name: carbonic acid [4-(6-amidino-1-ethyl-indol-2-yl)-2-carboxyoxy-1-[2-(ketomethylene)pyrrolidino]-1-pyrrolidino-butyl] ester Formula: C26H33N5O7 MolecularWeight: 527.56952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N5O7/c1-2-30-19(14-17-7-8-18(23(27)28)15-21(17)30)9-10-22(37-24(33)34)26(38-25(35)36,29-11-3-4-12-29)31-13-5-6-20(31)16-32/h7-8,14-15,22H,2-6,9-13H2,1H3,(H3,27,28)(H,33,34)(H,35,36)