disodium (2S)-2-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]butanedioate

Systemtic Name: disodium (2S)-2-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]butanedioate Openeye Name: disodium (2S)-2-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]butanedioate CAS Name: disodium (2S)-2-[[(E)-1-oxo-3-(4-phenylphenyl)prop-2-enyl]amino]butanedioate IUPAC Name: disodium (2S)-2-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]butanedioate Traditional Name: disodium (2S)-2-[[(E)-3-(4-phenylphenyl)acryloyl]amino]succinate Formula: C19H15NNa2O5 MolecularWeight: 383.30564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C=CC(=O)NC(CC(=O)[O-])C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)/C=C/C(=O)N[C@@H](CC(=O)[O-])C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C19H17NO5.2Na/c21-17(20-16(19(24)25)12-18(22)23)11-8-13-6-9-15(10-7-13)14-4-2-1-3-5-14;;/h1-11,16H,12H2,(H,20,21)(H,22,23)(H,24,25);;/q;2*+1/p-2/b11-8+;;/t16-;;/m0../s1