ethyl 4-[4-[(4-methoxyphenyl)methyl]-3-oxidanylidene-1,4-benzoxazin-7-yl]-3-phenyl-butanoate

Systemtic Name: ethyl 4-[4-[(4-methoxyphenyl)methyl]-3-oxidanylidene-1,4-benzoxazin-7-yl]-3-phenyl-butanoate Openeye Name: ethyl 4-[4-[(4-methoxyphenyl)methyl]-3-oxo-1,4-benzoxazin-7-yl]-3-phenyl-butanoate CAS Name: 4-[4-[(4-methoxyphenyl)methyl]-3-oxo-1,4-benzoxazin-7-yl]-3-phenylbutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[(4-methoxyphenyl)methyl]-3-oxo-1,4-benzoxazin-7-yl]-3-phenylbutanoate Traditional Name: 4-(3-keto-4-p-anisyl-1,4-benzoxazin-7-yl)-3-phenyl-butyric acid ethyl ester Formula: C28H29NO5 MolecularWeight: 459.53356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=C(C=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC(CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=C(C=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C28H29NO5/c1-3-33-28(31)17-23(22-7-5-4-6-8-22)15-21-11-14-25-26(16-21)34-19-27(30)29(25)18-20-9-12-24(32-2)13-10-20/h4-14,16,23H,3,15,17-19H2,1-2H3