1-[2-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]cinnolin-4-one

Systemtic Name: 1-[2-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]cinnolin-4-one Openeye Name: 1-[2-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-oxo-ethyl]cinnolin-4-one CAS Name: 1-[2-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pyrrolidinyl]-2-oxoethyl]-4-cinnolinone IUPAC Name: 1-[2-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidin-1-yl]-2-oxoethyl]cinnolin-4-one Traditional Name: 1-[2-[(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidino]-2-keto-ethyl]cinnolin-4-one Formula: C22H21N3O4 MolecularWeight: 391.41984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CN2C3=CC=CC=C3C(=O)C=N2)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CN2C3=CC=CC=C3C(=O)C=N2)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C22H21N3O4/c26-19-13-23-25(18-5-2-1-4-16(18)19)14-22(27)24-9-3-6-17(24)15-7-8-20-21(12-15)29-11-10-28-20/h1-2,4-5,7-8,12-13,17H,3,6,9-11,14H2/t17-/m0/s1