(E)-1-(azepan-1-yl)-3-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxy-phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(azepan-1-yl)-3-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxy-phenyl]prop-2-en-1-one Openeye Name: (E)-1-(azepan-1-yl)-3-[4-[(3,5-dimethylisoxazol-4-yl)methoxy]-3-methoxy-phenyl]prop-2-en-1-one CAS Name: (E)-1-(1-azepanyl)-3-[4-[(3,5-dimethyl-4-isoxazolyl)methoxy]-3-methoxyphenyl]-2-propen-1-one IUPAC Name: (E)-1-(azepan-1-yl)-3-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxyphenyl]prop-2-en-1-one Traditional Name: (E)-1-(azepan-1-yl)-3-[4-[(3,5-dimethylisoxazol-4-yl)methoxy]-3-methoxy-phenyl]prop-2-en-1-one Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC2=C(C=C(C=C2)C=CC(=O)N3CCCCCC3)OC

Isomeric SMILES

CC1=C(C(=NO1)C)COC2=C(C=C(C=C2)/C=C/C(=O)N3CCCCCC3)OC

InChI

InChI=1S/C22H28N2O4/c1-16-19(17(2)28-23-16)15-27-20-10-8-18(14-21(20)26-3)9-11-22(25)24-12-6-4-5-7-13-24/h8-11,14H,4-7,12-13,15H2,1-3H3/b11-9+