sodium 3-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]propanoate

Systemtic Name: sodium 3-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]propanoate Openeye Name: sodium 3-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]propanoate CAS Name: sodium 3-[[(Z)-(6-oxo-1-cyclohexa-2,4-dienylidene)-phenylmethyl]amino]propanoate IUPAC Name: sodium 3-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)-phenylmethyl]amino]propanoate Traditional Name: sodium 3-[[(Z)-(6-ketocyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]propionate Formula: C16H14NNaO3 MolecularWeight: 291.27703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C2C=CC=CC2=O)NCCC(=O)[O-].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)/C(=C/2\C=CC=CC2=O)/NCCC(=O)[O-].[Na+]

InChI

InChI=1S/C16H15NO3.Na/c18-14-9-5-4-8-13(14)16(17-11-10-15(19)20)12-6-2-1-3-7-12;/h1-9,17H,10-11H2,(H,19,20);/q;+1/p-1/b16-13-;