methyl 5-chloranyl-2-[1-[2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethyl]piperidin-4-yl]benzoate

Systemtic Name: methyl 5-chloranyl-2-[1-[2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethyl]piperidin-4-yl]benzoate Openeye Name: methyl 5-chloro-2-[1-[2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]-4-piperidyl]benzoate CAS Name: 5-chloro-2-[1-[2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]-4-piperidinyl]benzoic acid methyl ester IUPAC Name: methyl 5-chloro-2-[1-[2-(3-oxo-1,4-benzoxazin-4-yl)ethyl]piperidin-4-yl]benzoate Traditional Name: 5-chloro-2-[1-[2-(3-keto-1,4-benzoxazin-4-yl)ethyl]-4-piperidyl]benzoic acid methyl ester Formula: C23H25ClN2O4 MolecularWeight: 428.9086

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)Cl)C2CCN(CC2)CCN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)Cl)C2CCN(CC2)CCN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C23H25ClN2O4/c1-29-23(28)19-14-17(24)6-7-18(19)16-8-10-25(11-9-16)12-13-26-20-4-2-3-5-21(20)30-15-22(26)27/h2-7,14,16H,8-13,15H2,1H3