ethyl 3-[1,3-benzodioxol-5-ylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]amino]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[1,3-benzodioxol-5-ylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]amino]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[1,3-benzodioxol-5-ylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]amino]-3-oxo-propanoate CAS Name: 3-[1,3-benzodioxol-5-ylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]amino]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[1,3-benzodioxol-5-ylmethyl-[(5-phenyl-1H-pyrazol-4-yl)methyl]amino]-3-oxopropanoate Traditional Name: 3-keto-3-[(5-phenyl-1H-pyrazol-4-yl)methyl-piperonyl-amino]propionic acid ethyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC(=O)N(CC1=CC2=C(C=C1)OCO2)CC3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O5/c1-2-29-22(28)11-21(27)26(13-16-8-9-19-20(10-16)31-15-30-19)14-18-12-24-25-23(18)17-6-4-3-5-7-17/h3-10,12H,2,11,13-15H2,1H3,(H,24,25)