ethyl 2-[4-[4-(phenylmethyl)phenoxy]butyl-prop-2-enyl-amino]propanoate

Systemtic Name: ethyl 2-[4-[4-(phenylmethyl)phenoxy]butyl-prop-2-enyl-amino]propanoate Openeye Name: ethyl 2-[allyl-[4-(4-benzylphenoxy)butyl]amino]propanoate CAS Name: 2-[4-[4-(phenylmethyl)phenoxy]butyl-prop-2-enylamino]propanoic acid ethyl ester IUPAC Name: ethyl 2-[4-(4-benzylphenoxy)butyl-prop-2-enylamino]propanoate Traditional Name: 2-[allyl-[4-(4-benzylphenoxy)butyl]amino]propionic acid ethyl ester Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)N(CCCCOC1=CC=C(C=C1)CC2=CC=CC=C2)CC=C

Isomeric SMILES

CCOC(=O)C(C)N(CCCCOC1=CC=C(C=C1)CC2=CC=CC=C2)CC=C

InChI

InChI=1S/C25H33NO3/c1-4-17-26(21(3)25(27)28-5-2)18-9-10-19-29-24-15-13-23(14-16-24)20-22-11-7-6-8-12-22/h4,6-8,11-16,21H,1,5,9-10,17-20H2,2-3H3