sodium 11-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]undecanoate

Systemtic Name: sodium 11-[[(Z)-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]undecanoate Openeye Name: sodium 11-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]undecanoate CAS Name: sodium 11-[[(Z)-(6-oxo-1-cyclohexa-2,4-dienylidene)-phenylmethyl]amino]undecanoate IUPAC Name: sodium 11-[[(Z)-(6-oxocyclohexa-2,4-dien-1-ylidene)-phenylmethyl]amino]undecanoate Traditional Name: sodium 11-[[(Z)-(6-ketocyclohexa-2,4-dien-1-ylidene)-phenyl-methyl]amino]undecanoate Formula: C24H30NNaO3 MolecularWeight: 403.48967

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H31NO3.Na/c26-22-17-12-11-16-21(22)24(20-14-8-7-9-15-20)25-19-13-6-4-2-1-3-5-10-18-23(27)28;/h7-9,11-12,14-17,25H,1-6,10,13,18-19H2,(H,27,28);/q;+1/p-1/b24-21-;