methyl 3-[3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[3-(3-oxidanylidene-1,4-benzoxazin-4-yl)propanoylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[3-(3-oxo-1,4-benzoxazin-4-yl)propanoylamino]-3-phenyl-propanoate CAS Name: 3-[[1-oxo-3-(3-oxo-1,4-benzoxazin-4-yl)propyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[3-(3-oxo-1,4-benzoxazin-4-yl)propanoylamino]-3-phenylpropanoate Traditional Name: 3-[3-(3-keto-1,4-benzoxazin-4-yl)propanoylamino]-3-phenyl-propionic acid methyl ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)CCN2C(=O)COC3=CC=CC=C32

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)CCN2C(=O)COC3=CC=CC=C32

InChI

InChI=1S/C21H22N2O5/c1-27-21(26)13-16(15-7-3-2-4-8-15)22-19(24)11-12-23-17-9-5-6-10-18(17)28-14-20(23)25/h2-10,16H,11-14H2,1H3,(H,22,24)