7-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 7-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 7-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-4H-1,4-benzoxazin-3-one CAS Name: 7-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 7-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 7-(4-veratroylpiperazino)-4H-1,4-benzoxazin-3-one Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)NC(=O)CO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=CC4=C(C=C3)NC(=O)CO4)OC

InChI

InChI=1S/C21H23N3O5/c1-27-17-6-3-14(11-19(17)28-2)21(26)24-9-7-23(8-10-24)15-4-5-16-18(12-15)29-13-20(25)22-16/h3-6,11-12H,7-10,13H2,1-2H3,(H,22,25)