(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) (E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate

Systemtic Name: (1-morpholin-4-yl-1-oxidanylidene-propan-2-yl) (E)-3-[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoate Openeye Name: (1-methyl-2-morpholino-2-oxo-ethyl) (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)prop-2-enoate CAS Name: (E)-3-[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]-2-propenoic acid [1-(4-morpholinyl)-1-oxopropan-2-yl] ester IUPAC Name: (1-morpholin-4-yl-1-oxopropan-2-yl) (E)-3-(1-benzyl-3-phenylpyrazol-4-yl)prop-2-enoate Traditional Name: (E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)acrylic acid (2-keto-1-methyl-2-morpholino-ethyl) ester Formula: C26H27N3O4 MolecularWeight: 445.51028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCOCC1)OC(=O)C=CC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCOCC1)OC(=O)/C=C/C2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4/c1-20(26(31)28-14-16-32-17-15-28)33-24(30)13-12-23-19-29(18-21-8-4-2-5-9-21)27-25(23)22-10-6-3-7-11-22/h2-13,19-20H,14-18H2,1H3/b13-12+