tert-butyl 3-[4-[[5-carbamimidoyl-1-(2-methoxyethyl)benzimidazol-2-yl]methoxy]phenoxy]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[4-[[5-carbamimidoyl-1-(2-methoxyethyl)benzimidazol-2-yl]methoxy]phenoxy]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[4-[[5-carbamimidoyl-1-(2-methoxyethyl)benzimidazol-2-yl]methoxy]phenoxy]pyrrolidine-1-carboxylate CAS Name: 3-[4-[[5-carbamimidoyl-1-(2-methoxyethyl)-2-benzimidazolyl]methoxy]phenoxy]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[4-[[5-carbamimidoyl-1-(2-methoxyethyl)benzimidazol-2-yl]methoxy]phenoxy]pyrrolidine-1-carboxylate Traditional Name: 3-[4-[[5-amidino-1-(2-methoxyethyl)benzimidazol-2-yl]methoxy]phenoxy]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C27H35N5O5 MolecularWeight: 509.5973

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)OC2=CC=C(C=C2)OCC3=NC4=C(N3CCOC)C=CC(=C4)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)OC2=CC=C(C=C2)OCC3=NC4=C(N3CCOC)C=CC(=C4)C(=N)N

InChI

InChI=1S/C27H35N5O5/c1-27(2,3)37-26(33)31-12-11-21(16-31)36-20-8-6-19(7-9-20)35-17-24-30-22-15-18(25(28)29)5-10-23(22)32(24)13-14-34-4/h5-10,15,21H,11-14,16-17H2,1-4H3,(H3,28,29)