3-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]-8-methyl-quinazolin-4-one

Systemtic Name: 3-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-4-oxidanylidene-butyl]-8-methyl-quinazolin-4-one Openeye Name: 3-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-4-oxo-butyl]-8-methyl-quinazolin-4-one CAS Name: 3-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-4-oxobutyl]-8-methyl-4-quinazolinone IUPAC Name: 3-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-4-oxobutyl]-8-methylquinazolin-4-one Traditional Name: 3-[4-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-4-keto-butyl]-8-methyl-quinazolin-4-one Formula: C26H29N3O4 MolecularWeight: 447.52616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)N3CCCC3C4=CC5=C(C=C4)OCCCO5

InChI

InChI=1S/C26H29N3O4/c1-18-6-2-7-20-25(18)27-17-28(26(20)31)12-4-9-24(30)29-13-3-8-21(29)19-10-11-22-23(16-19)33-15-5-14-32-22/h2,6-7,10-11,16-17,21H,3-5,8-9,12-15H2,1H3