1-[(2S)-1-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylate

Systemtic Name: 1-[(2S)-1-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]-1-oxidanylidene-propan-2-yl]pyrazole-4-carboxylate Openeye Name: 1-[(1S)-2-[[(1R)-3-(2-furyl)-1-methyl-propyl]amino]-1-methyl-2-oxo-ethyl]pyrazole-4-carboxylate CAS Name: 1-[(2S)-1-[[(2R)-4-(2-furanyl)butan-2-yl]amino]-1-oxopropan-2-yl]-4-pyrazolecarboxylate IUPAC Name: 1-[(2S)-1-[[(2R)-4-(furan-2-yl)butan-2-yl]amino]-1-oxopropan-2-yl]pyrazole-4-carboxylate Traditional Name: 1-[(1S)-2-[[(1R)-3-(2-furyl)-1-methyl-propyl]amino]-2-keto-1-methyl-ethyl]pyrazole-4-carboxylate Formula: C15H18N3O4- MolecularWeight: 304.32112

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CO1)NC(=O)C(C)N2C=C(C=N2)C(=O)[O-]

Isomeric SMILES

C[C@H](CCC1=CC=CO1)NC(=O)[C@H](C)N2C=C(C=N2)C(=O)[O-]

InChI

InChI=1S/C15H19N3O4/c1-10(5-6-13-4-3-7-22-13)17-14(19)11(2)18-9-12(8-16-18)15(20)21/h3-4,7-11H,5-6H2,1-2H3,(H,17,19)(H,20,21)/p-1/t10-,11+/m1/s1