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

Systemtic Name: 6-azanyl-5-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]ethanoyl]-1-propyl-pyrimidine-2,4-dione Openeye Name: 6-amino-5-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]acetyl]-1-propyl-pyrimidine-2,4-dione CAS Name: 6-amino-5-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-1-oxoethyl]-1-propylpyrimidine-2,4-dione IUPAC Name: 6-amino-5-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]acetyl]-1-propylpyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]acetyl]-1-propyl-pyrimidine-2,4-quinone Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(=O)NC1=O)C(=O)CN2CCCC2C3=CC4=C(C=C3)OCCCO4)N

Isomeric SMILES

CCCN1C(=C(C(=O)NC1=O)C(=O)CN2CCCC2C3=CC4=C(C=C3)OCCCO4)N

InChI

InChI=1S/C22H28N4O5/c1-2-8-26-20(23)19(21(28)24-22(26)29)16(27)13-25-9-3-5-15(25)14-6-7-17-18(12-14)31-11-4-10-30-17/h6-7,12,15H,2-5,8-11,13,23H2,1H3,(H,24,28,29)