4-[cyclopropyl-[(4-ethylphenyl)methyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[cyclopropyl-[(4-ethylphenyl)methyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[cyclopropyl-[(4-ethylphenyl)methyl]amino]-4-oxo-butanoic acid CAS Name: 4-[cyclopropyl-[(4-ethylphenyl)methyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[cyclopropyl-[(4-ethylphenyl)methyl]amino]-4-oxobutanoic acid Traditional Name: 4-[cyclopropyl-(4-ethylbenzyl)amino]-4-keto-butyric acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C2CC2)C(=O)CCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C2CC2)C(=O)CCC(=O)O

InChI

InChI=1S/C16H21NO3/c1-2-12-3-5-13(6-4-12)11-17(14-7-8-14)15(18)9-10-16(19)20/h3-6,14H,2,7-11H2,1H3,(H,19,20)