N-[4-chloranyl-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[4-chloranyl-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3,4,5-triethoxy-benzamide Openeye Name: N-[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3,4,5-triethoxy-benzamide CAS Name: N-[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3,4,5-triethoxybenzamide IUPAC Name: N-[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3,4,5-triethoxybenzamide Traditional Name: N-[4-chloro-3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]-3,4,5-triethoxy-benzamide Formula: C28H29ClN2O5 MolecularWeight: 508.99326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=C(C=C2)Cl)C3=NC4=C(O3)C=C(C(=C4)C)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=C(C=C2)Cl)C3=NC4=C(O3)C=C(C(=C4)C)C

InChI

InChI=1S/C28H29ClN2O5/c1-6-33-24-13-18(14-25(34-7-2)26(24)35-8-3)27(32)30-19-9-10-21(29)20(15-19)28-31-22-11-16(4)17(5)12-23(22)36-28/h9-15H,6-8H2,1-5H3,(H,30,32)