3-ethyl-1-[2-[(2S)-2-(4-methoxyphenyl)azepan-1-yl]-2-oxidanylidene-ethyl]quinazoline-2,4-dione

Systemtic Name: 3-ethyl-1-[2-[(2S)-2-(4-methoxyphenyl)azepan-1-yl]-2-oxidanylidene-ethyl]quinazoline-2,4-dione Openeye Name: 3-ethyl-1-[2-[(2S)-2-(4-methoxyphenyl)azepan-1-yl]-2-oxo-ethyl]quinazoline-2,4-dione CAS Name: 3-ethyl-1-[2-[(2S)-2-(4-methoxyphenyl)-1-azepanyl]-2-oxoethyl]quinazoline-2,4-dione IUPAC Name: 3-ethyl-1-[2-[(2S)-2-(4-methoxyphenyl)azepan-1-yl]-2-oxoethyl]quinazoline-2,4-dione Traditional Name: 3-ethyl-1-[2-keto-2-[(2S)-2-(4-methoxyphenyl)azepan-1-yl]ethyl]quinazoline-2,4-quinone Formula: C25H29N3O4 MolecularWeight: 435.51546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N(C1=O)CC(=O)N3CCCCCC3C4=CC=C(C=C4)OC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N(C1=O)CC(=O)N3CCCCC[C@H]3C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H29N3O4/c1-3-26-24(30)20-9-6-7-11-22(20)28(25(26)31)17-23(29)27-16-8-4-5-10-21(27)18-12-14-19(32-2)15-13-18/h6-7,9,11-15,21H,3-5,8,10,16-17H2,1-2H3/t21-/m0/s1