(3S)-N-(3-methoxypropyl)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: (3S)-N-(3-methoxypropyl)-1-oxidanylidene-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: (3S)-N-(3-methoxypropyl)-1-oxo-3-phenyl-isochromane-6-carboxamide CAS Name: (3S)-N-(3-methoxypropyl)-1-oxo-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: (3S)-N-(3-methoxypropyl)-1-oxo-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: (3S)-1-keto-N-(3-methoxypropyl)-3-phenyl-isochroman-6-carboxamide Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)C1=CC2=C(C=C1)C(=O)OC(C2)C3=CC=CC=C3

Isomeric SMILES

COCCCNC(=O)C1=CC2=C(C=C1)C(=O)O[C@@H](C2)C3=CC=CC=C3

InChI

InChI=1S/C20H21NO4/c1-24-11-5-10-21-19(22)15-8-9-17-16(12-15)13-18(25-20(17)23)14-6-3-2-4-7-14/h2-4,6-9,12,18H,5,10-11,13H2,1H3,(H,21,22)/t18-/m0/s1