5-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-6-methyl-1H-pyrimidine-2,4-dione

Systemtic Name: 5-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxidanylidene-propyl]-6-methyl-1H-pyrimidine-2,4-dione Openeye Name: 5-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxo-propyl]-6-methyl-1H-pyrimidine-2,4-dione CAS Name: 5-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-3-oxopropyl]-6-methyl-1H-pyrimidine-2,4-dione IUPAC Name: 5-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-3-oxopropyl]-6-methyl-1H-pyrimidine-2,4-dione Traditional Name: 5-[3-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-3-keto-propyl]-6-methyl-uracil Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=O)N1)CCC(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC1=C(C(=O)NC(=O)N1)CCC(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H25N3O5/c1-13-15(20(26)23-21(27)22-13)6-8-19(25)24-9-2-4-16(24)14-5-7-17-18(12-14)29-11-3-10-28-17/h5,7,12,16H,2-4,6,8-11H2,1H3,(H2,22,23,26,27)