[2-(oxidanylidenemethylidene)pyrrolidin-1-yl] 4-(5-carbamimidoyl-1-methyl-indol-2-yl)-2-pyrrolidin-1-yl-butanoate

Systemtic Name: [2-(oxidanylidenemethylidene)pyrrolidin-1-yl] 4-(5-carbamimidoyl-1-methyl-indol-2-yl)-2-pyrrolidin-1-yl-butanoate Openeye Name: [2-(oxomethylene)pyrrolidin-1-yl] 4-(5-carbamimidoyl-1-methyl-indol-2-yl)-2-pyrrolidin-1-yl-butanoate CAS Name: 4-(5-carbamimidoyl-1-methyl-2-indolyl)-2-(1-pyrrolidinyl)butanoic acid [2-(oxomethylidene)-1-pyrrolidinyl] ester IUPAC Name: [2-(oxomethylidene)pyrrolidin-1-yl] 4-(5-carbamimidoyl-1-methylindol-2-yl)-2-pyrrolidin-1-ylbutanoate Traditional Name: 4-(5-amidino-1-methyl-indol-2-yl)-2-pyrrolidino-butyric acid [2-(ketomethylene)pyrrolidino] ester Formula: C23H29N5O3 MolecularWeight: 423.50806

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)C(=N)N)C=C1CCC(C(=O)ON3CCCC3=C=O)N4CCCC4

Isomeric SMILES

CN1C2=C(C=C(C=C2)C(=N)N)C=C1CCC(C(=O)ON3CCCC3=C=O)N4CCCC4

InChI

InChI=1S/C23H29N5O3/c1-26-18(14-17-13-16(22(24)25)6-8-20(17)26)7-9-21(27-10-2-3-11-27)23(30)31-28-12-4-5-19(28)15-29/h6,8,13-14,21H,2-5,7,9-12H2,1H3,(H3,24,25)