[2-(oxidanylidenemethylidene)pyrrolidin-1-yl] 2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-2-pyrrolidin-1-yl-hexanoate

Systemtic Name: [2-(oxidanylidenemethylidene)pyrrolidin-1-yl] 2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-2-pyrrolidin-1-yl-hexanoate Openeye Name: [2-(oxomethylene)pyrrolidin-1-yl] 2-[2-(6-carbamimidoyl-1-ethyl-indol-2-yl)ethyl]-2-pyrrolidin-1-yl-hexanoate CAS Name: 2-[2-(6-carbamimidoyl-1-ethyl-2-indolyl)ethyl]-2-(1-pyrrolidinyl)hexanoic acid [2-(oxomethylidene)-1-pyrrolidinyl] ester IUPAC Name: [2-(oxomethylidene)pyrrolidin-1-yl] 2-[2-(6-carbamimidoyl-1-ethylindol-2-yl)ethyl]-2-pyrrolidin-1-ylhexanoate Traditional Name: 2-[2-(6-amidino-1-ethyl-indol-2-yl)ethyl]-2-pyrrolidino-hexanoic acid [2-(ketomethylene)pyrrolidino] ester Formula: C28H39N5O3 MolecularWeight: 493.64096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC1=CC2=C(N1CC)C=C(C=C2)C(=N)N)(C(=O)ON3CCCC3=C=O)N4CCCC4

Isomeric SMILES

CCCCC(CCC1=CC2=C(N1CC)C=C(C=C2)C(=N)N)(C(=O)ON3CCCC3=C=O)N4CCCC4

InChI

InChI=1S/C28H39N5O3/c1-3-5-13-28(31-15-6-7-16-31,27(35)36-33-17-8-9-24(33)20-34)14-12-23-18-21-10-11-22(26(29)30)19-25(21)32(23)4-2/h10-11,18-19H,3-9,12-17H2,1-2H3,(H3,29,30)