N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-3-(phenoxymethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-3-(phenoxymethyl)-1-benzofuran-2-carboxamide Openeye Name: N-[4-(4-ethylpiperazin-1-yl)-3-methyl-phenyl]-3-(phenoxymethyl)benzofuran-2-carboxamide CAS Name: N-[4-(4-ethyl-1-piperazinyl)-3-methylphenyl]-3-(phenoxymethyl)-2-benzofurancarboxamide IUPAC Name: N-[4-(4-ethylpiperazin-1-yl)-3-methylphenyl]-3-(phenoxymethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[4-(4-ethylpiperazino)-3-methyl-phenyl]-3-(phenoxymethyl)coumarilamide Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C4=CC=CC=C4O3)COC5=CC=CC=C5)C

InChI

InChI=1S/C29H31N3O3/c1-3-31-15-17-32(18-16-31)26-14-13-22(19-21(26)2)30-29(33)28-25(20-34-23-9-5-4-6-10-23)24-11-7-8-12-27(24)35-28/h4-14,19H,3,15-18,20H2,1-2H3,(H,30,33)