(E)-3-(1,3-benzoxazol-2-yl)-4-(4-piperidin-1-ylphenyl)but-3-enoate

Systemtic Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-piperidin-1-ylphenyl)but-3-enoate Openeye Name: (E)-3-(1,3-benzoxazol-2-yl)-4-[4-(1-piperidyl)phenyl]but-3-enoate CAS Name: (E)-3-(1,3-benzoxazol-2-yl)-4-[4-(1-piperidinyl)phenyl]-3-butenoate IUPAC Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-piperidin-1-ylphenyl)but-3-enoate Traditional Name: (E)-3-(1,3-benzoxazol-2-yl)-4-(4-piperidinophenyl)but-3-enoate Formula: C22H21N2O3- MolecularWeight: 361.41374

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C=C(CC(=O)[O-])C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)/C=C(\CC(=O)[O-])/C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C22H22N2O3/c25-21(26)15-17(22-23-19-6-2-3-7-20(19)27-22)14-16-8-10-18(11-9-16)24-12-4-1-5-13-24/h2-3,6-11,14H,1,4-5,12-13,15H2,(H,25,26)/p-1/b17-14+