4-[[(Z)-3-(1,3-benzodioxol-5-yl)-2-(furan-2-ylcarbonylamino)prop-2-enoyl]amino]butanoate

Systemtic Name: 4-[[(Z)-3-(1,3-benzodioxol-5-yl)-2-(furan-2-ylcarbonylamino)prop-2-enoyl]amino]butanoate Openeye Name: 4-[[(Z)-3-(1,3-benzodioxol-5-yl)-2-(furan-2-carbonylamino)prop-2-enoyl]amino]butanoate CAS Name: 4-[[(Z)-3-(1,3-benzodioxol-5-yl)-2-[[2-furanyl(oxo)methyl]amino]-1-oxoprop-2-enyl]amino]butanoate IUPAC Name: 4-[[(Z)-3-(1,3-benzodioxol-5-yl)-2-(furan-2-carbonylamino)prop-2-enoyl]amino]butanoate Traditional Name: 4-[[(Z)-3-(1,3-benzodioxol-5-yl)-2-(2-furoylamino)acryloyl]amino]butyrate Formula: C19H17N2O7- MolecularWeight: 385.34748

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NCCCC(=O)[O-])NC(=O)C3=CC=CO3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(/C(=O)NCCCC(=O)[O-])\NC(=O)C3=CC=CO3

InChI

InChI=1S/C19H18N2O7/c22-17(23)4-1-7-20-18(24)13(21-19(25)15-3-2-8-26-15)9-12-5-6-14-16(10-12)28-11-27-14/h2-3,5-6,8-10H,1,4,7,11H2,(H,20,24)(H,21,25)(H,22,23)/p-1/b13-9-