5-[(E)-3-[4-methoxy-3-(2-methylpropoxy)phenyl]prop-2-enoyl]-1,3-dihydrobenzimidazol-2-one

Systemtic Name: 5-[(E)-3-[4-methoxy-3-(2-methylpropoxy)phenyl]prop-2-enoyl]-1,3-dihydrobenzimidazol-2-one Openeye Name: 5-[(E)-3-(3-isobutoxy-4-methoxy-phenyl)prop-2-enoyl]-1,3-dihydrobenzimidazol-2-one CAS Name: 5-[(E)-3-[4-methoxy-3-(2-methylpropoxy)phenyl]-1-oxoprop-2-enyl]-1,3-dihydrobenzimidazol-2-one IUPAC Name: 5-[(E)-3-[4-methoxy-3-(2-methylpropoxy)phenyl]prop-2-enoyl]-1,3-dihydrobenzimidazol-2-one Traditional Name: 5-[(E)-3-(3-isobutoxy-4-methoxy-phenyl)acryloyl]-1,3-dihydrobenzimidazol-2-one Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC(=C1)C=CC(=O)C2=CC3=C(C=C2)NC(=O)N3)OC

Isomeric SMILES

CC(C)COC1=C(C=CC(=C1)/C=C/C(=O)C2=CC3=C(C=C2)NC(=O)N3)OC

InChI

InChI=1S/C21H22N2O4/c1-13(2)12-27-20-10-14(5-9-19(20)26-3)4-8-18(24)15-6-7-16-17(11-15)23-21(25)22-16/h4-11,13H,12H2,1-3H3,(H2,22,23,25)/b8-4+