(7-chloranyl-1,3-benzodioxol-5-yl)methyl 2-[cyclohexyl(methyl)carbamoyl]benzoate

Systemtic Name: (7-chloranyl-1,3-benzodioxol-5-yl)methyl 2-[cyclohexyl(methyl)carbamoyl]benzoate Openeye Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 2-[cyclohexyl(methyl)carbamoyl]benzoate CAS Name: 2-[[cyclohexyl(methyl)amino]-oxomethyl]benzoic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (7-chloro-1,3-benzodioxol-5-yl)methyl 2-[cyclohexyl(methyl)carbamoyl]benzoate Traditional Name: 2-[cyclohexyl(methyl)carbamoyl]benzoic acid (7-chloro-1,3-benzodioxol-5-yl)methyl ester Formula: C23H24ClNO5 MolecularWeight: 429.89336

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)C2=CC=CC=C2C(=O)OCC3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

CN(C1CCCCC1)C(=O)C2=CC=CC=C2C(=O)OCC3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C23H24ClNO5/c1-25(16-7-3-2-4-8-16)22(26)17-9-5-6-10-18(17)23(27)28-13-15-11-19(24)21-20(12-15)29-14-30-21/h5-6,9-12,16H,2-4,7-8,13-14H2,1H3