4-[3-(aminomethyl)phenyl]-N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]benzamide

Systemtic Name: 4-[3-(aminomethyl)phenyl]-N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]benzamide Openeye Name: 4-[3-(aminomethyl)phenyl]-N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]benzamide CAS Name: 4-[3-(aminomethyl)phenyl]-N-[2-(5-carbamimidoyl-2,3-dihydrobenzofuran-3-yl)ethyl]benzamide IUPAC Name: 4-[3-(aminomethyl)phenyl]-N-[2-(5-carbamimidoyl-2,3-dihydro-1-benzofuran-3-yl)ethyl]benzamide Traditional Name: N-[2-(5-amidinocoumaran-3-yl)ethyl]-4-[3-(aminomethyl)phenyl]benzamide Formula: C25H26N4O2 MolecularWeight: 414.49954

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(O1)C=CC(=C2)C(=N)N)CCNC(=O)C3=CC=C(C=C3)C4=CC(=CC=C4)CN

Isomeric SMILES

C1C(C2=C(O1)C=CC(=C2)C(=N)N)CCNC(=O)C3=CC=C(C=C3)C4=CC(=CC=C4)CN

InChI

InChI=1S/C25H26N4O2/c26-14-16-2-1-3-19(12-16)17-4-6-18(7-5-17)25(30)29-11-10-21-15-31-23-9-8-20(24(27)28)13-22(21)23/h1-9,12-13,21H,10-11,14-15,26H2,(H3,27,28)(H,29,30)