tert-butyl (3S)-3-[[(1R)-1-(4-methoxyphenyl)ethyl]-prop-2-enyl-amino]-3-phenyl-propanoate

Systemtic Name: tert-butyl (3S)-3-[[(1R)-1-(4-methoxyphenyl)ethyl]-prop-2-enyl-amino]-3-phenyl-propanoate Openeye Name: tert-butyl (3S)-3-[allyl-[(1R)-1-(4-methoxyphenyl)ethyl]amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[(1R)-1-(4-methoxyphenyl)ethyl]-prop-2-enylamino]-3-phenylpropanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-[[(1R)-1-(4-methoxyphenyl)ethyl]-prop-2-enylamino]-3-phenylpropanoate Traditional Name: (3S)-3-[allyl-[(1R)-1-(4-methoxyphenyl)ethyl]amino]-3-phenyl-propionic acid tert-butyl ester Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)OC)N(CC=C)C(CC(=O)OC(C)(C)C)C2=CC=CC=C2

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)OC)N(CC=C)[C@@H](CC(=O)OC(C)(C)C)C2=CC=CC=C2

InChI

InChI=1S/C25H33NO3/c1-7-17-26(19(2)20-13-15-22(28-6)16-14-20)23(21-11-9-8-10-12-21)18-24(27)29-25(3,4)5/h7-16,19,23H,1,17-18H2,2-6H3/t19-,23+/m1/s1