(2S)-3-methyl-2-[[5-methyl-4-(pyrrolidin-1-ylmethyl)furan-2-yl]carbonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[[5-methyl-4-(pyrrolidin-1-ylmethyl)furan-2-yl]carbonylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[[5-methyl-4-(pyrrolidin-1-ylmethyl)furan-2-carbonyl]amino]butanoic acid CAS Name: (2S)-3-methyl-2-[[[5-methyl-4-(1-pyrrolidinylmethyl)-2-furanyl]-oxomethyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[[5-methyl-4-(pyrrolidin-1-ylmethyl)furan-2-carbonyl]amino]butanoic acid Traditional Name: (2S)-3-methyl-2-[[5-methyl-4-(pyrrolidinomethyl)-2-furoyl]amino]butyric acid Formula: C16H24N2O4 MolecularWeight: 308.37276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)NC(C(C)C)C(=O)O)CN2CCCC2

Isomeric SMILES

CC1=C(C=C(O1)C(=O)N[C@@H](C(C)C)C(=O)O)CN2CCCC2

InChI

InChI=1S/C16H24N2O4/c1-10(2)14(16(20)21)17-15(19)13-8-12(11(3)22-13)9-18-6-4-5-7-18/h8,10,14H,4-7,9H2,1-3H3,(H,17,19)(H,20,21)/t14-/m0/s1