[1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-butan-2-yl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate

Systemtic Name: [1-(1,3-benzodioxol-5-ylamino)-1-oxidanylidene-butan-2-yl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate Openeye Name: 1-(1,3-benzodioxol-5-ylcarbamoyl)propyl 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate CAS Name: 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoic acid [1-(1,3-benzodioxol-5-ylamino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(1,3-benzodioxol-5-ylamino)-1-oxobutan-2-yl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate Traditional Name: 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoic acid 1-(1,3-benzodioxol-5-ylcarbamoyl)propyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC=C(C=C3)C4=NC(=C(N4)C)C

Isomeric SMILES

CCC(C(=O)NC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC=C(C=C3)C4=NC(=C(N4)C)C

InChI

InChI=1S/C23H23N3O5/c1-4-18(22(27)26-17-9-10-19-20(11-17)30-12-29-19)31-23(28)16-7-5-15(6-8-16)21-24-13(2)14(3)25-21/h5-11,18H,4,12H2,1-3H3,(H,24,25)(H,26,27)