1-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]cinnolin-4-one

Systemtic Name: 1-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]cinnolin-4-one Openeye Name: 1-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxo-propyl]cinnolin-4-one CAS Name: 1-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-3-oxopropyl]-4-cinnolinone IUPAC Name: 1-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxopropyl]cinnolin-4-one Traditional Name: 1-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-3-keto-propyl]cinnolin-4-one Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCN2C3=CC=CC=C3C(=O)C=N2)C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

C1CC(N(C1)C(=O)CCN2C3=CC=CC=C3C(=O)C=N2)C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C24H25N3O4/c28-21-16-25-27(20-6-2-1-5-18(20)21)12-10-24(29)26-11-3-7-19(26)17-8-9-22-23(15-17)31-14-4-13-30-22/h1-2,5-6,8-9,15-16,19H,3-4,7,10-14H2