methyl 4-[4-oxidanylidene-6-(2-phenylpropan-2-yl)-3,1-benzoxazin-2-yl]benzoate

Systemtic Name: methyl 4-[4-oxidanylidene-6-(2-phenylpropan-2-yl)-3,1-benzoxazin-2-yl]benzoate Openeye Name: methyl 4-[6-(1-methyl-1-phenyl-ethyl)-4-oxo-3,1-benzoxazin-2-yl]benzoate CAS Name: 4-[4-oxo-6-(2-phenylpropan-2-yl)-3,1-benzoxazin-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-oxo-6-(2-phenylpropan-2-yl)-3,1-benzoxazin-2-yl]benzoate Traditional Name: 4-(6-cumyl-4-keto-3,1-benzoxazin-2-yl)benzoic acid methyl ester Formula: C25H21NO4 MolecularWeight: 399.43854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=CC3=C(C=C2)N=C(OC3=O)C4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=CC3=C(C=C2)N=C(OC3=O)C4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C25H21NO4/c1-25(2,18-7-5-4-6-8-18)19-13-14-21-20(15-19)24(28)30-22(26-21)16-9-11-17(12-10-16)23(27)29-3/h4-15H,1-3H3