methyl 4-[[2-oxidanylidene-2-[(4-phenyloxan-4-yl)methylamino]ethanoyl]amino]benzoate

Systemtic Name: methyl 4-[[2-oxidanylidene-2-[(4-phenyloxan-4-yl)methylamino]ethanoyl]amino]benzoate Openeye Name: methyl 4-[[2-oxo-2-[(4-phenyltetrahydropyran-4-yl)methylamino]acetyl]amino]benzoate CAS Name: 4-[[1,2-dioxo-2-[(4-phenyl-4-oxanyl)methylamino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-oxo-2-[(4-phenyloxan-4-yl)methylamino]acetyl]amino]benzoate Traditional Name: 4-[[2-keto-2-[(4-phenyltetrahydropyran-4-yl)methylamino]acetyl]amino]benzoic acid methyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCC2(CCOCC2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NCC2(CCOCC2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O5/c1-28-21(27)16-7-9-18(10-8-16)24-20(26)19(25)23-15-22(11-13-29-14-12-22)17-5-3-2-4-6-17/h2-10H,11-15H2,1H3,(H,23,25)(H,24,26)