methyl 5-butyl-4-phenyl-1,3-benzoxazole-2-carboxylate

Systemtic Name: methyl 5-butyl-4-phenyl-1,3-benzoxazole-2-carboxylate Openeye Name: methyl 5-butyl-4-phenyl-1,3-benzoxazole-2-carboxylate CAS Name: 5-butyl-4-phenyl-1,3-benzoxazole-2-carboxylic acid methyl ester IUPAC Name: methyl 5-butyl-4-phenyl-1,3-benzoxazole-2-carboxylate Traditional Name: 5-butyl-4-phenyl-1,3-benzoxazole-2-carboxylic acid methyl ester Formula: C19H19NO3 MolecularWeight: 309.35906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C(C=C1)OC(=N2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=C(C2=C(C=C1)OC(=N2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C19H19NO3/c1-3-4-8-14-11-12-15-17(20-18(23-15)19(21)22-2)16(14)13-9-6-5-7-10-13/h5-7,9-12H,3-4,8H2,1-2H3