(3R)-1-oxidanylidene-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: (3R)-1-oxidanylidene-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)-3,4-dihydroisochromene-3-carboxamide Openeye Name: (3R)-1-oxo-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)isochromane-3-carboxamide CAS Name: (3R)-1-oxo-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: (3R)-1-oxo-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)-3,4-dihydroisochromene-3-carboxamide Traditional Name: (3R)-1-keto-N-(3-pyrrolidinoquinoxalin-2-yl)isochroman-3-carboxamide Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)C4CC5=CC=CC=C5C(=O)O4

Isomeric SMILES

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)[C@H]4CC5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C22H20N4O3/c27-21(18-13-14-7-1-2-8-15(14)22(28)29-18)25-19-20(26-11-5-6-12-26)24-17-10-4-3-9-16(17)23-19/h1-4,7-10,18H,5-6,11-13H2,(H,23,25,27)/t18-/m1/s1