6-chloranyl-3-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-chloranyl-3-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 6-chloro-3-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 6-chloro-3-[[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 6-chloro-3-[[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 6-chloro-3-[(4-veratrylpiperazino)methyl]-1,3-benzoxazol-2-one Formula: C21H24ClN3O4 MolecularWeight: 417.88596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)CN3C4=C(C=C(C=C4)Cl)OC3=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)CN3C4=C(C=C(C=C4)Cl)OC3=O)OC

InChI

InChI=1S/C21H24ClN3O4/c1-27-18-6-3-15(11-20(18)28-2)13-23-7-9-24(10-8-23)14-25-17-5-4-16(22)12-19(17)29-21(25)26/h3-6,11-12H,7-10,13-14H2,1-2H3