ethyl 4-[[[2-[1,3-benzodioxol-5-ylmethyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-propyl-carbamoyl]amino]benzoate

Systemtic Name: ethyl 4-[[[2-[1,3-benzodioxol-5-ylmethyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxidanylidene-ethyl]-propyl-carbamoyl]amino]benzoate Openeye Name: ethyl 4-[[[2-[1,3-benzodioxol-5-ylmethyl-[(5-methyl-2-furyl)methyl]amino]-2-oxo-ethyl]-propyl-carbamoyl]amino]benzoate CAS Name: 4-[[[[2-[1,3-benzodioxol-5-ylmethyl-[(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-propylamino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[[2-[1,3-benzodioxol-5-ylmethyl-[(5-methylfuran-2-yl)methyl]amino]-2-oxoethyl]-propylcarbamoyl]amino]benzoate Traditional Name: 4-[[[2-keto-2-[(5-methyl-2-furyl)methyl-piperonyl-amino]ethyl]-propyl-carbamoyl]amino]benzoic acid ethyl ester Formula: C29H33N3O7 MolecularWeight: 535.58822

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=C(O3)C)C(=O)NC4=CC=C(C=C4)C(=O)OCC

Isomeric SMILES

CCCN(CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=CC=C(O3)C)C(=O)NC4=CC=C(C=C4)C(=O)OCC

InChI

InChI=1S/C29H33N3O7/c1-4-14-31(29(35)30-23-10-8-22(9-11-23)28(34)36-5-2)18-27(33)32(17-24-12-6-20(3)39-24)16-21-7-13-25-26(15-21)38-19-37-25/h6-13,15H,4-5,14,16-19H2,1-3H3,(H,30,35)