propan-2-yl 3-(1,3-benzodioxol-5-ylcarbonylamino)-3-phenyl-propanoate

Systemtic Name: propan-2-yl 3-(1,3-benzodioxol-5-ylcarbonylamino)-3-phenyl-propanoate Openeye Name: isopropyl 3-(1,3-benzodioxole-5-carbonylamino)-3-phenyl-propanoate CAS Name: 3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(1,3-benzodioxole-5-carbonylamino)-3-phenylpropanoate Traditional Name: 3-phenyl-3-(piperonyloylamino)propionic acid isopropyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)OC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H21NO5/c1-13(2)26-19(22)11-16(14-6-4-3-5-7-14)21-20(23)15-8-9-17-18(10-15)25-12-24-17/h3-10,13,16H,11-12H2,1-2H3,(H,21,23)