2-ethoxyethyl 3-[4-(hexadecan-2-ylamino)phenyl]prop-2-ynoate

Systemtic Name: 2-ethoxyethyl 3-[4-(hexadecan-2-ylamino)phenyl]prop-2-ynoate Openeye Name: 2-ethoxyethyl 3-[4-(1-methylpentadecylamino)phenyl]prop-2-ynoate CAS Name: 3-[4-(hexadecan-2-ylamino)phenyl]-2-propynoic acid 2-ethoxyethyl ester IUPAC Name: 2-ethoxyethyl 3-[4-(hexadecan-2-ylamino)phenyl]prop-2-ynoate Traditional Name: 3-[4-(1-methylpentadecylamino)phenyl]propiolic acid 2-ethoxyethyl ester Formula: C29H47NO3 MolecularWeight: 457.68838

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C)NC1=CC=C(C=C1)C#CC(=O)OCCOCC

Isomeric SMILES

CCCCCCCCCCCCCCC(C)NC1=CC=C(C=C1)C#CC(=O)OCCOCC

InChI

InChI=1S/C29H47NO3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-26(3)30-28-21-18-27(19-22-28)20-23-29(31)33-25-24-32-5-2/h18-19,21-22,26,30H,4-17,24-25H2,1-3H3