4-[(phenylmethyl)-[(E)-3-phenylprop-2-enyl]carbamoyl]cyclobutane-1,2,3-tricarboxylic acid

Systemtic Name: 4-[(phenylmethyl)-[(E)-3-phenylprop-2-enyl]carbamoyl]cyclobutane-1,2,3-tricarboxylic acid Openeye Name: 4-[benzyl-[(E)-cinnamyl]carbamoyl]cyclobutane-1,2,3-tricarboxylic acid CAS Name: 4-[oxo-[(phenylmethyl)-[(E)-3-phenylprop-2-enyl]amino]methyl]cyclobutane-1,2,3-tricarboxylic acid IUPAC Name: 4-[benzyl-[(E)-3-phenylprop-2-enyl]carbamoyl]cyclobutane-1,2,3-tricarboxylic acid Traditional Name: 4-[benzyl-[(E)-cinnamyl]carbamoyl]cyclobutane-1,2,3-tricarboxylic acid Formula: C24H23NO7 MolecularWeight: 437.44192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC=CC2=CC=CC=C2)C(=O)C3C(C(C3C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CN(C/C=C/C2=CC=CC=C2)C(=O)C3C(C(C3C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C24H23NO7/c26-21(17-18(22(27)28)20(24(31)32)19(17)23(29)30)25(14-16-10-5-2-6-11-16)13-7-12-15-8-3-1-4-9-15/h1-12,17-20H,13-14H2,(H,27,28)(H,29,30)(H,31,32)/b12-7+