N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3,6,7-trimethyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3,6,7-trimethyl-1-benzofuran-2-carboxamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3,6,7-trimethyl-benzofuran-2-carboxamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3,6,7-trimethyl-2-benzofurancarboxamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3,6,7-trimethyl-1-benzofuran-2-carboxamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-3,6,7-trimethyl-coumarilamide Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=C(O2)C(=O)NCC3COC4=CC=CC=C4O3)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=C(O2)C(=O)NC[C@H]3COC4=CC=CC=C4O3)C)C

InChI

InChI=1S/C21H21NO4/c1-12-8-9-16-14(3)20(26-19(16)13(12)2)21(23)22-10-15-11-24-17-6-4-5-7-18(17)25-15/h4-9,15H,10-11H2,1-3H3,(H,22,23)/t15-/m0/s1