tert-butyl (3R)-3-[[(1R)-1-phenylethyl]-prop-2-enyl-amino]-7-phenylmethoxy-heptanoate

Systemtic Name: tert-butyl (3R)-3-[[(1R)-1-phenylethyl]-prop-2-enyl-amino]-7-phenylmethoxy-heptanoate Openeye Name: tert-butyl (3R)-3-[allyl-[(1R)-1-phenylethyl]amino]-7-benzyloxy-heptanoate CAS Name: (3R)-3-[[(1R)-1-phenylethyl]-prop-2-enylamino]-7-phenylmethoxyheptanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R)-3-[[(1R)-1-phenylethyl]-prop-2-enylamino]-7-phenylmethoxyheptanoate Traditional Name: (3R)-3-[allyl-[(1R)-1-phenylethyl]amino]-7-benzoxy-enanthic acid tert-butyl ester Formula: C29H41NO3 MolecularWeight: 451.64074

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC=C)C(CCCCOCC2=CC=CC=C2)CC(=O)OC(C)(C)C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N(CC=C)[C@H](CCCCOCC2=CC=CC=C2)CC(=O)OC(C)(C)C

InChI

InChI=1S/C29H41NO3/c1-6-20-30(24(2)26-17-11-8-12-18-26)27(22-28(31)33-29(3,4)5)19-13-14-21-32-23-25-15-9-7-10-16-25/h6-12,15-18,24,27H,1,13-14,19-23H2,2-5H3/t24-,27-/m1/s1