tert-butyl 2-[4-[(6-carbamimidoyl-1H-indol-2-yl)carbonylamino]cyclohexyl]oxyethanoate

Systemtic Name: tert-butyl 2-[4-[(6-carbamimidoyl-1H-indol-2-yl)carbonylamino]cyclohexyl]oxyethanoate Openeye Name: tert-butyl 2-[4-[(6-carbamimidoyl-1H-indole-2-carbonyl)amino]cyclohexoxy]acetate CAS Name: 2-[4-[[(6-carbamimidoyl-1H-indol-2-yl)-oxomethyl]amino]cyclohexyl]oxyacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[(6-carbamimidoyl-1H-indole-2-carbonyl)amino]cyclohexyl]oxyacetate Traditional Name: 2-[4-[(6-amidino-1H-indole-2-carbonyl)amino]cyclohexoxy]acetic acid tert-butyl ester Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)COC1CCC(CC1)NC(=O)C2=CC3=C(N2)C=C(C=C3)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)COC1CCC(CC1)NC(=O)C2=CC3=C(N2)C=C(C=C3)C(=N)N

InChI

InChI=1S/C22H30N4O4/c1-22(2,3)30-19(27)12-29-16-8-6-15(7-9-16)25-21(28)18-10-13-4-5-14(20(23)24)11-17(13)26-18/h4-5,10-11,15-16,26H,6-9,12H2,1-3H3,(H3,23,24)(H,25,28)