propan-2-yl 3-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]-3-phenyl-propanoate Openeye Name: isopropyl 3-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]-3-phenyl-propanoate CAS Name: 3-[[(E)-3-(1,3-benzoxazol-2-yl)-1-oxoprop-2-enyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-[[(E)-3-(1,3-benzoxazol-2-yl)prop-2-enoyl]amino]-3-phenylpropanoate Traditional Name: 3-[[(E)-3-(1,3-benzoxazol-2-yl)acryloyl]amino]-3-phenyl-propionic acid isopropyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C=CC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)/C=C/C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C22H22N2O4/c1-15(2)27-22(26)14-18(16-8-4-3-5-9-16)23-20(25)12-13-21-24-17-10-6-7-11-19(17)28-21/h3-13,15,18H,14H2,1-2H3,(H,23,25)/b13-12+