methyl (3S)-3-[3-[bis(phenylmethyl)amino]phenyl]-2-ethanoyl-pentanoate

Systemtic Name: methyl (3S)-3-[3-[bis(phenylmethyl)amino]phenyl]-2-ethanoyl-pentanoate Openeye Name: methyl (3S)-2-acetyl-3-[3-(dibenzylamino)phenyl]pentanoate CAS Name: (3S)-2-acetyl-3-[3-[bis(phenylmethyl)amino]phenyl]pentanoic acid methyl ester IUPAC Name: methyl (3S)-2-acetyl-3-[3-(dibenzylamino)phenyl]pentanoate Traditional Name: (3S)-2-acetyl-3-[3-(dibenzylamino)phenyl]valeric acid methyl ester Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C(C(=O)C)C(=O)OC

Isomeric SMILES

CC[C@H](C1=CC(=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)C(C(=O)C)C(=O)OC

InChI

InChI=1S/C28H31NO3/c1-4-26(27(21(2)30)28(31)32-3)24-16-11-17-25(18-24)29(19-22-12-7-5-8-13-22)20-23-14-9-6-10-15-23/h5-18,26-27H,4,19-20H2,1-3H3/t26-,27?/m1/s1