N-tert-butyl-N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]benzamide

Systemtic Name: N-tert-butyl-N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]benzamide Openeye Name: N-tert-butyl-N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]benzamide CAS Name: N-tert-butyl-N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]benzamide IUPAC Name: N-tert-butyl-N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]benzamide Traditional Name: N-[2-(5-amidinocoumaran-3-yl)ethyl]-N-tert-butyl-benzamide Formula: C22H27N3O2 MolecularWeight: 365.46868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CCC1COC2=C1C=C(C=C2)C(=N)N)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)N(CCC1COC2=C1C=C(C=C2)C(=N)N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2/c1-22(2,3)25(21(26)15-7-5-4-6-8-15)12-11-17-14-27-19-10-9-16(20(23)24)13-18(17)19/h4-10,13,17H,11-12,14H2,1-3H3,(H3,23,24)