methyl 2-[(5-chloranyl-3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]-2-phenyl-ethanoate

Systemtic Name: methyl 2-[(5-chloranyl-3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]-2-phenyl-ethanoate Openeye Name: methyl 2-[(5-chloro-3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]-2-phenyl-acetate CAS Name: 2-[(5-chloro-3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-[(5-chloro-3-phenyl-7-propyl-1,2-benzoxazol-6-yl)oxy]-2-phenylacetate Traditional Name: 2-(5-chloro-3-phenyl-7-propyl-indoxazen-6-yl)oxy-2-phenyl-acetic acid methyl ester Formula: C25H22ClNO4 MolecularWeight: 435.89948

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC(=C1OC(C3=CC=CC=C3)C(=O)OC)Cl)C(=NO2)C4=CC=CC=C4

Isomeric SMILES

CCCC1=C2C(=CC(=C1OC(C3=CC=CC=C3)C(=O)OC)Cl)C(=NO2)C4=CC=CC=C4

InChI

InChI=1S/C25H22ClNO4/c1-3-10-18-23-19(21(27-31-23)16-11-6-4-7-12-16)15-20(26)24(18)30-22(25(28)29-2)17-13-8-5-9-14-17/h4-9,11-15,22H,3,10H2,1-2H3