methyl (2R,5S)-5-[bis(phenylmethyl)amino]-6-cyclohexyl-2-(2-methylpropyl)-4-oxidanylidene-hexanoate

Systemtic Name: methyl (2R,5S)-5-[bis(phenylmethyl)amino]-6-cyclohexyl-2-(2-methylpropyl)-4-oxidanylidene-hexanoate Openeye Name: methyl (2R,5S)-6-cyclohexyl-5-(dibenzylamino)-2-isobutyl-4-oxo-hexanoate CAS Name: (2R,5S)-5-[bis(phenylmethyl)amino]-6-cyclohexyl-2-(2-methylpropyl)-4-oxohexanoic acid methyl ester IUPAC Name: methyl (2R,5S)-6-cyclohexyl-5-(dibenzylamino)-2-(2-methylpropyl)-4-oxohexanoate Traditional Name: (2R,5S)-6-cyclohexyl-5-(dibenzylamino)-2-isobutyl-4-keto-hexanoic acid methyl ester Formula: C31H43NO3 MolecularWeight: 477.67802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CC(=O)C(CC1CCCCC1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)C[C@H](CC(=O)[C@H](CC1CCCCC1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C31H43NO3/c1-24(2)19-28(31(34)35-3)21-30(33)29(20-25-13-7-4-8-14-25)32(22-26-15-9-5-10-16-26)23-27-17-11-6-12-18-27/h5-6,9-12,15-18,24-25,28-29H,4,7-8,13-14,19-23H2,1-3H3/t28-,29+/m1/s1