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1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylate

1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylate

Systemtic Name:1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]pyrazole-3-carboxylate
Openeye Name:1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxo-propyl]pyrazole-3-carboxylate
CAS Name:1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-3-pyrazolecarboxylate
IUPAC Name:1-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]pyrazole-3-carboxylate
Traditional Name:1-[3-(homoveratrylamino)-3-keto-propyl]pyrazole-3-carboxylate
Formula: C17H20N3O5-
MolecularWeight: 346.3578
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCN2C=CC(=N2)C(=O)[O-])OC


Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCN2C=CC(=N2)C(=O)[O-])OC


InChI

InChI=1S/C17H21N3O5/c1-24-14-4-3-12(11-15(14)25-2)5-8-18-16(21)7-10-20-9-6-13(19-20)17(22)23/h3-4,6,9,11H,5,7-8,10H2,1-2H3,(H,18,21)(H,22,23)/p-1


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