tert-butyl 3-[5-azanyl-2-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]phenyl]propanoate

Systemtic Name: tert-butyl 3-[5-azanyl-2-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]phenyl]propanoate Openeye Name: tert-butyl 3-[5-amino-2-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]phenyl]propanoate CAS Name: 3-[5-amino-2-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]phenyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-[5-amino-2-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]phenyl]propanoate Traditional Name: 3-[5-amino-2-[(E)-6-(4-methoxyphenyl)hex-5-enoxy]phenyl]propionic acid tert-butyl ester Formula: C26H35NO4 MolecularWeight: 425.5604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CCC1=C(C=CC(=C1)N)OCCCCC=CC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)(C)OC(=O)CCC1=C(C=CC(=C1)N)OCCCC/C=C/C2=CC=C(C=C2)OC

InChI

InChI=1S/C26H35NO4/c1-26(2,3)31-25(28)17-12-21-19-22(27)13-16-24(21)30-18-8-6-5-7-9-20-10-14-23(29-4)15-11-20/h7,9-11,13-16,19H,5-6,8,12,17-18,27H2,1-4H3/b9-7+