N-[(2S)-1-(cyclododecylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-7-methoxy-1-benzofuran-2-carboxamide

Systemtic Name: N-[(2S)-1-(cyclododecylamino)-3-oxidanyl-1-oxidanylidene-propan-2-yl]-7-methoxy-1-benzofuran-2-carboxamide Openeye Name: N-[(1S)-2-(cyclododecylamino)-1-(hydroxymethyl)-2-oxo-ethyl]-7-methoxy-benzofuran-2-carboxamide CAS Name: N-[(2S)-1-(cyclododecylamino)-3-hydroxy-1-oxopropan-2-yl]-7-methoxy-2-benzofurancarboxamide IUPAC Name: N-[(2S)-1-(cyclododecylamino)-3-hydroxy-1-oxopropan-2-yl]-7-methoxy-1-benzofuran-2-carboxamide Traditional Name: N-[(1S)-2-(cyclododecylamino)-2-keto-1-methylol-ethyl]-7-methoxy-coumarilamide Formula: C25H36N2O5 MolecularWeight: 444.56374

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=C2)C(=O)NC(CO)C(=O)NC3CCCCCCCCCCC3

Isomeric SMILES

COC1=CC=CC2=C1OC(=C2)C(=O)N[C@@H](CO)C(=O)NC3CCCCCCCCCCC3

InChI

InChI=1S/C25H36N2O5/c1-31-21-15-11-12-18-16-22(32-23(18)21)25(30)27-20(17-28)24(29)26-19-13-9-7-5-3-2-4-6-8-10-14-19/h11-12,15-16,19-20,28H,2-10,13-14,17H2,1H3,(H,26,29)(H,27,30)/t20-/m0/s1