2-[2-[2-[4-(2-cyclohexylethyl)-3-oxidanylidene-1,4-benzoxazin-2-yl]ethoxy]phenyl]ethanoic acid

Systemtic Name: 2-[2-[2-[4-(2-cyclohexylethyl)-3-oxidanylidene-1,4-benzoxazin-2-yl]ethoxy]phenyl]ethanoic acid Openeye Name: 2-[2-[2-[4-(2-cyclohexylethyl)-3-oxo-1,4-benzoxazin-2-yl]ethoxy]phenyl]acetic acid CAS Name: 2-[2-[2-[4-(2-cyclohexylethyl)-3-oxo-1,4-benzoxazin-2-yl]ethoxy]phenyl]acetic acid IUPAC Name: 2-[2-[2-[4-(2-cyclohexylethyl)-3-oxo-1,4-benzoxazin-2-yl]ethoxy]phenyl]acetic acid Traditional Name: 2-[2-[2-[4-(2-cyclohexylethyl)-3-keto-1,4-benzoxazin-2-yl]ethoxy]phenyl]acetic acid Formula: C26H31NO5 MolecularWeight: 437.52804

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCN2C3=CC=CC=C3OC(C2=O)CCOC4=CC=CC=C4CC(=O)O

Isomeric SMILES

C1CCC(CC1)CCN2C3=CC=CC=C3OC(C2=O)CCOC4=CC=CC=C4CC(=O)O

InChI

InChI=1S/C26H31NO5/c28-25(29)18-20-10-4-6-12-22(20)31-17-15-24-26(30)27(16-14-19-8-2-1-3-9-19)21-11-5-7-13-23(21)32-24/h4-7,10-13,19,24H,1-3,8-9,14-18H2,(H,28,29)