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1-[2-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]-2-oxidanylidene-ethyl]pyrazole-3-carboxylic acid
1-[2-[[(1S)-1-(4-methoxyphenyl)ethyl]amino]-2-oxidanylidene-ethyl]pyrazole-3-carboxylic acid
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Descriptors Computed from Structure
Canonical SMILES:
CC(C1=CC=C(C=C1)OC)NC(=O)CN2C=CC(=N2)C(=O)O
Isomeric SMILES
C[C@@H](C1=CC=C(C=C1)OC)NC(=O)CN2C=CC(=N2)C(=O)O
InChI
InChI=1S/C15H17N3O4/c1-10(11-3-5-12(22-2)6-4-11)16-14(19)9-18-8-7-13(17-18)15(20)21/h3-8,10H,9H2,1-2H3,(H,16,19)(H,20,21)/t10-/m0/s1
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- 1-[2-[[(1S)-1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]amino]-2-oxidanylidene-ethyl]pyrazole-3-carboxylate
- 1-[2-[[(1S)-1-(1-ethyl-5-methyl-pyrazol-4-yl)ethyl]amino]-2-oxidanylidene-ethyl]pyrazole-3-carboxylic acid
