methyl 4-oxidanylidene-4-[2-[[(E)-11-phenylundec-10-enyl]amino]phenyl]butanoate

Systemtic Name: methyl 4-oxidanylidene-4-[2-[[(E)-11-phenylundec-10-enyl]amino]phenyl]butanoate Openeye Name: methyl 4-oxo-4-[2-[[(E)-11-phenylundec-10-enyl]amino]phenyl]butanoate CAS Name: 4-oxo-4-[2-[[(E)-11-phenylundec-10-enyl]amino]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-[2-[[(E)-11-phenylundec-10-enyl]amino]phenyl]butanoate Traditional Name: 4-keto-4-[2-[[(E)-11-phenylundec-10-enyl]amino]phenyl]butyric acid methyl ester Formula: C28H37NO3 MolecularWeight: 435.59828

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)C1=CC=CC=C1NCCCCCCCCCC=CC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCC(=O)C1=CC=CC=C1NCCCCCCCCC/C=C/C2=CC=CC=C2

InChI

InChI=1S/C28H37NO3/c1-32-28(31)22-21-27(30)25-19-13-14-20-26(25)29-23-15-8-6-4-2-3-5-7-10-16-24-17-11-9-12-18-24/h9-14,16-20,29H,2-8,15,21-23H2,1H3/b16-10+