N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1-oxidanylidene-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-1-oxo-isochromane-3-carboxamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-1-oxo-3,4-dihydroisochromene-3-carboxamide Traditional Name: 1-keto-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]isochroman-3-carboxamide Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2CC3=CC=CC=C3C(=O)O2)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C2CC3=CC=CC=C3C(=O)O2)N4CCCC4

InChI

InChI=1S/C23H26N2O4/c1-28-18-9-6-8-17(13-18)20(25-11-4-5-12-25)15-24-22(26)21-14-16-7-2-3-10-19(16)23(27)29-21/h2-3,6-10,13,20-21H,4-5,11-12,14-15H2,1H3,(H,24,26)