tert-butyl (3R,4S,5S)-3-methoxy-5-methyl-4-[methyl-(phenylmethyl)amino]heptanoate

Systemtic Name: tert-butyl (3R,4S,5S)-3-methoxy-5-methyl-4-[methyl-(phenylmethyl)amino]heptanoate Openeye Name: tert-butyl (3R,4S,5S)-4-[benzyl(methyl)amino]-3-methoxy-5-methyl-heptanoate CAS Name: (3R,4S,5S)-3-methoxy-5-methyl-4-[methyl-(phenylmethyl)amino]heptanoic acid tert-butyl ester IUPAC Name: tert-butyl (3R,4S,5S)-4-[benzyl(methyl)amino]-3-methoxy-5-methylheptanoate Traditional Name: (3R,4S,5S)-4-[benzyl(methyl)amino]-3-methoxy-5-methyl-enanthic acid tert-butyl ester Formula: C21H35NO3 MolecularWeight: 349.5075

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(CC(=O)OC(C)(C)C)OC)N(C)CC1=CC=CC=C1

Isomeric SMILES

CC[C@H](C)[C@@H]([C@@H](CC(=O)OC(C)(C)C)OC)N(C)CC1=CC=CC=C1

InChI

InChI=1S/C21H35NO3/c1-8-16(2)20(22(6)15-17-12-10-9-11-13-17)18(24-7)14-19(23)25-21(3,4)5/h9-13,16,18,20H,8,14-15H2,1-7H3/t16-,18+,20-/m0/s1