[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(1-ethylbenzotriazol-5-yl)methanone

Systemtic Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(1-ethylbenzotriazol-5-yl)methanone Openeye Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(1-ethylbenzotriazol-5-yl)methanone CAS Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-(1-ethyl-5-benzotriazolyl)methanone IUPAC Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-(1-ethylbenzotriazol-5-yl)methanone Traditional Name: [2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-(1-ethylbenzotriazol-5-yl)methanone Formula: C22H24N4O3 MolecularWeight: 392.45096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5)N=N1

InChI

InChI=1S/C22H24N4O3/c1-2-26-19-8-6-16(13-17(19)23-24-26)22(27)25-10-3-5-18(25)15-7-9-20-21(14-15)29-12-4-11-28-20/h6-9,13-14,18H,2-5,10-12H2,1H3