[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl] 1,3-benzoxazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl] 1,3-benzoxazole-4-carboxylate Openeye Name: [2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl] 1,3-benzoxazole-4-carboxylate CAS Name: 1,3-benzoxazole-4-carboxylic acid [2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl] ester IUPAC Name: [2-(4-benzylpiperazin-1-yl)-2-oxoethyl] 1,3-benzoxazole-4-carboxylate Traditional Name: 1,3-benzoxazole-4-carboxylic acid [2-(4-benzylpiperazino)-2-keto-ethyl] ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)COC(=O)C3=C4C(=CC=C3)OC=N4

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)COC(=O)C3=C4C(=CC=C3)OC=N4

InChI

InChI=1S/C21H21N3O4/c25-19(14-27-21(26)17-7-4-8-18-20(17)22-15-28-18)24-11-9-23(10-12-24)13-16-5-2-1-3-6-16/h1-8,15H,9-14H2