tert-butyl (4S)-4-[bis(phenylmethyl)amino]-3-oxidanylidene-heptanoate

Systemtic Name: tert-butyl (4S)-4-[bis(phenylmethyl)amino]-3-oxidanylidene-heptanoate Openeye Name: tert-butyl (4S)-4-(dibenzylamino)-3-oxo-heptanoate CAS Name: (4S)-4-[bis(phenylmethyl)amino]-3-oxoheptanoic acid tert-butyl ester IUPAC Name: tert-butyl (4S)-4-(dibenzylamino)-3-oxoheptanoate Traditional Name: (4S)-4-(dibenzylamino)-3-keto-enanthic acid tert-butyl ester Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)CC(=O)OC(C)(C)C)N(CC1=CC=CC=C1)CC2=CC=CC=C2

Isomeric SMILES

CCC[C@@H](C(=O)CC(=O)OC(C)(C)C)N(CC1=CC=CC=C1)CC2=CC=CC=C2

InChI

InChI=1S/C25H33NO3/c1-5-12-22(23(27)17-24(28)29-25(2,3)4)26(18-20-13-8-6-9-14-20)19-21-15-10-7-11-16-21/h6-11,13-16,22H,5,12,17-19H2,1-4H3/t22-/m0/s1