[2-[[(4-chlorophenyl)-phenyl-methyl]amino]-2-oxidanylidene-ethyl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-[[(4-chlorophenyl)-phenyl-methyl]amino]-2-oxidanylidene-ethyl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-[[(4-chlorophenyl)-phenyl-methyl]amino]-2-oxo-ethyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-[[(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[[(4-chlorophenyl)-phenylmethyl]amino]-2-oxoethyl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [2-[[(4-chlorophenyl)-phenyl-methyl]amino]-2-keto-ethyl] ester Formula: C23H18ClNO5 MolecularWeight: 423.84572

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)NC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)NC(C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H18ClNO5/c24-18-9-6-16(7-10-18)22(15-4-2-1-3-5-15)25-21(26)13-28-23(27)17-8-11-19-20(12-17)30-14-29-19/h1-12,22H,13-14H2,(H,25,26)