8-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-6-methyl-pyrido[2,3-d]pyrimidin-7-one

Systemtic Name: 8-[(3-chloranyl-4-methoxy-phenyl)methyl]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-6-methyl-pyrido[2,3-d]pyrimidin-7-one Openeye Name: 8-[(3-chloro-4-methoxy-phenyl)methyl]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-6-methyl-pyrido[2,3-d]pyrimidin-7-one CAS Name: 8-[(3-chloro-4-methoxyphenyl)methyl]-2-[2-(hydroxymethyl)-1-pyrrolidinyl]-6-methyl-7-pyrido[2,3-d]pyrimidinone IUPAC Name: 8-[(3-chloro-4-methoxyphenyl)methyl]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-6-methylpyrido[2,3-d]pyrimidin-7-one Traditional Name: 8-(3-chloro-4-methoxy-benzyl)-6-methyl-2-(2-methylolpyrrolidino)pyrido[2,3-d]pyrimidin-7-one Formula: C21H23ClN4O3 MolecularWeight: 414.88532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CN=C(N=C2N(C1=O)CC3=CC(=C(C=C3)OC)Cl)N4CCCC4CO

Isomeric SMILES

CC1=CC2=CN=C(N=C2N(C1=O)CC3=CC(=C(C=C3)OC)Cl)N4CCCC4CO

InChI

InChI=1S/C21H23ClN4O3/c1-13-8-15-10-23-21(25-7-3-4-16(25)12-27)24-19(15)26(20(13)28)11-14-5-6-18(29-2)17(22)9-14/h5-6,8-10,16,27H,3-4,7,11-12H2,1-2H3