methyl 2-[3-oxidanylidene-1-[(2-propan-2-yl-1,3-benzoxazol-5-yl)carbonyl]piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[3-oxidanylidene-1-[(2-propan-2-yl-1,3-benzoxazol-5-yl)carbonyl]piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-(2-isopropyl-1,3-benzoxazole-5-carbonyl)-3-oxo-piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[oxo-(2-propan-2-yl-1,3-benzoxazol-5-yl)methyl]-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-oxo-1-(2-propan-2-yl-1,3-benzoxazole-5-carbonyl)piperazin-2-yl]acetate Traditional Name: 2-[1-(2-isopropyl-1,3-benzoxazole-5-carbonyl)-3-keto-piperazin-2-yl]acetic acid methyl ester Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)N3CCNC(=O)C3CC(=O)OC

Isomeric SMILES

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)N3CCNC(=O)C3CC(=O)OC

InChI

InChI=1S/C18H21N3O5/c1-10(2)17-20-12-8-11(4-5-14(12)26-17)18(24)21-7-6-19-16(23)13(21)9-15(22)25-3/h4-5,8,10,13H,6-7,9H2,1-3H3,(H,19,23)