(2R,3S)-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-3-methyl-pentanoate

Systemtic Name: (2R,3S)-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-3-methyl-pentanoate Openeye Name: (2R,3S)-2-[[(E)-3-(2-furyl)prop-2-enoyl]amino]-3-methyl-pentanoate CAS Name: (2R,3S)-2-[[(E)-3-(2-furanyl)-1-oxoprop-2-enyl]amino]-3-methylpentanoate IUPAC Name: (2R,3S)-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]-3-methylpentanoate Traditional Name: (2R,3S)-2-[[(E)-3-(2-furyl)acryloyl]amino]-3-methyl-valerate Formula: C13H16NO4- MolecularWeight: 250.27044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])NC(=O)C=CC1=CC=CO1

Isomeric SMILES

CC[C@H](C)[C@H](C(=O)[O-])NC(=O)/C=C/C1=CC=CO1

InChI

InChI=1S/C13H17NO4/c1-3-9(2)12(13(16)17)14-11(15)7-6-10-5-4-8-18-10/h4-9,12H,3H2,1-2H3,(H,14,15)(H,16,17)/p-1/b7-6+/t9-,12+/m0/s1