3-oxidanylidene-3-[4-(6-phenylhexylamino)phenyl]propanoate

Systemtic Name: 3-oxidanylidene-3-[4-(6-phenylhexylamino)phenyl]propanoate Openeye Name: 3-oxo-3-[4-(6-phenylhexylamino)phenyl]propanoate CAS Name: 3-oxo-3-[4-(6-phenylhexylamino)phenyl]propanoate IUPAC Name: 3-oxo-3-[4-(6-phenylhexylamino)phenyl]propanoate Traditional Name: 3-keto-3-[4-(6-phenylhexylamino)phenyl]propionate Formula: C21H24NO3- MolecularWeight: 338.42016

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCNC2=CC=C(C=C2)C(=O)CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCNC2=CC=C(C=C2)C(=O)CC(=O)[O-]

InChI

InChI=1S/C21H25NO3/c23-20(16-21(24)25)18-11-13-19(14-12-18)22-15-7-2-1-4-8-17-9-5-3-6-10-17/h3,5-6,9-14,22H,1-2,4,7-8,15-16H2,(H,24,25)/p-1