3-[2-[4-(4-chloranyl-3-methoxy-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-[4-(4-chloranyl-3-methoxy-phenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-[4-(4-chloro-3-methoxy-phenyl)piperazin-1-yl]-2-oxo-ethyl]-1,3-benzoxazol-2-one CAS Name: 3-[2-[4-(4-chloro-3-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[2-[4-(4-chloro-3-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[4-(4-chloro-3-methoxy-phenyl)piperazino]-2-keto-ethyl]-1,3-benzoxazol-2-one Formula: C20H20ClN3O4 MolecularWeight: 401.8435

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)N2CCN(CC2)C(=O)CN3C4=CC=CC=C4OC3=O)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)N2CCN(CC2)C(=O)CN3C4=CC=CC=C4OC3=O)Cl

InChI

InChI=1S/C20H20ClN3O4/c1-27-18-12-14(6-7-15(18)21)22-8-10-23(11-9-22)19(25)13-24-16-4-2-3-5-17(16)28-20(24)26/h2-7,12H,8-11,13H2,1H3