methyl 3-(1,3-benzodioxol-5-ylcarbonylamino)-3-(2-chlorophenyl)propanoate

Systemtic Name: methyl 3-(1,3-benzodioxol-5-ylcarbonylamino)-3-(2-chlorophenyl)propanoate Openeye Name: methyl 3-(1,3-benzodioxole-5-carbonylamino)-3-(2-chlorophenyl)propanoate CAS Name: 3-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3-(2-chlorophenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(1,3-benzodioxole-5-carbonylamino)-3-(2-chlorophenyl)propanoate Traditional Name: 3-(2-chlorophenyl)-3-(piperonyloylamino)propionic acid methyl ester Formula: C18H16ClNO5 MolecularWeight: 361.77634

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1Cl)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H16ClNO5/c1-23-17(21)9-14(12-4-2-3-5-13(12)19)20-18(22)11-6-7-15-16(8-11)25-10-24-15/h2-8,14H,9-10H2,1H3,(H,20,22)