(E)-1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-(4-tert-butylphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-(4-tert-butylphenyl)prop-2-en-1-one Openeye Name: (E)-1-[4-(1,3-benzoxazol-2-yl)-1-piperidyl]-3-(4-tert-butylphenyl)prop-2-en-1-one CAS Name: (E)-1-[4-(1,3-benzoxazol-2-yl)-1-piperidinyl]-3-(4-tert-butylphenyl)-2-propen-1-one IUPAC Name: (E)-1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-(4-tert-butylphenyl)prop-2-en-1-one Traditional Name: (E)-1-[4-(1,3-benzoxazol-2-yl)piperidino]-3-(4-tert-butylphenyl)prop-2-en-1-one Formula: C25H28N2O2 MolecularWeight: 388.50202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C=CC(=O)N2CCC(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)/C=C/C(=O)N2CCC(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C25H28N2O2/c1-25(2,3)20-11-8-18(9-12-20)10-13-23(28)27-16-14-19(15-17-27)24-26-21-6-4-5-7-22(21)29-24/h4-13,19H,14-17H2,1-3H3/b13-10+