tert-butyl (3S)-7-oxidanylidene-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]heptanoate

Systemtic Name: tert-butyl (3S)-7-oxidanylidene-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]heptanoate Openeye Name: tert-butyl (3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-7-oxo-heptanoate CAS Name: (3S)-7-oxo-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]heptanoic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-7-oxoheptanoate Traditional Name: (3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-7-keto-enanthic acid tert-butyl ester Formula: C26H35NO3 MolecularWeight: 409.561

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CC=CC=C2)C(CCCC=O)CC(=O)OC(C)(C)C

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(CC2=CC=CC=C2)[C@@H](CCCC=O)CC(=O)OC(C)(C)C

InChI

InChI=1S/C26H35NO3/c1-21(23-15-9-6-10-16-23)27(20-22-13-7-5-8-14-22)24(17-11-12-18-28)19-25(29)30-26(2,3)4/h5-10,13-16,18,21,24H,11-12,17,19-20H2,1-4H3/t21-,24-/m0/s1