N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chloranyl-phenyl]-4-propoxy-benzamide

Systemtic Name: N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chloranyl-phenyl]-4-propoxy-benzamide Openeye Name: N-[2-chloro-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]-4-propoxy-benzamide CAS Name: N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chlorophenyl]-4-propoxybenzamide IUPAC Name: N-[5-(5-butan-2-yl-1,3-benzoxazol-2-yl)-2-chlorophenyl]-4-propoxybenzamide Traditional Name: N-[2-chloro-5-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]-4-propoxy-benzamide Formula: C27H27ClN2O3 MolecularWeight: 462.96788

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC(=C4)C(C)CC)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC(=C4)C(C)CC)Cl

InChI

InChI=1S/C27H27ClN2O3/c1-4-14-32-21-10-6-18(7-11-21)26(31)29-23-16-20(8-12-22(23)28)27-30-24-15-19(17(3)5-2)9-13-25(24)33-27/h6-13,15-17H,4-5,14H2,1-3H3,(H,29,31)