(5S)-5-(benzotriazol-1-yl)-1-[(3,4-dimethoxyphenyl)methyl]pyrrolidin-2-one

Systemtic Name: (5S)-5-(benzotriazol-1-yl)-1-[(3,4-dimethoxyphenyl)methyl]pyrrolidin-2-one Openeye Name: (5S)-5-(benzotriazol-1-yl)-1-[(3,4-dimethoxyphenyl)methyl]pyrrolidin-2-one CAS Name: (5S)-5-(1-benzotriazolyl)-1-[(3,4-dimethoxyphenyl)methyl]-2-pyrrolidinone IUPAC Name: (5S)-5-(benzotriazol-1-yl)-1-[(3,4-dimethoxyphenyl)methyl]pyrrolidin-2-one Traditional Name: (5S)-5-(benzotriazol-1-yl)-1-veratryl-2-pyrrolidone Formula: C19H20N4O3 MolecularWeight: 352.3871

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(CCC2=O)N3C4=CC=CC=C4N=N3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2[C@H](CCC2=O)N3C4=CC=CC=C4N=N3)OC

InChI

InChI=1S/C19H20N4O3/c1-25-16-8-7-13(11-17(16)26-2)12-22-18(9-10-19(22)24)23-15-6-4-3-5-14(15)20-21-23/h3-8,11,18H,9-10,12H2,1-2H3/t18-/m0/s1