7-chloranyl-2-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 7-chloro-2-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[(2S)-2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 7-chloro-2-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 7-chloro-2-[[(2S)-2-(2,5-dimethoxyphenyl)pyrrolidino]methyl]-1H-quinazolin-4-one Formula: C21H22ClN3O3 MolecularWeight: 399.87068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)[C@@H]2CCCN2CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O3/c1-27-14-6-8-19(28-2)16(11-14)18-4-3-9-25(18)12-20-23-17-10-13(22)5-7-15(17)21(26)24-20/h5-8,10-11,18H,3-4,9,12H2,1-2H3,(H,23,24,26)/t18-/m0/s1