(phenylmethyl) (2S)-3-methyl-2-[(3-methyl-2,2-diphenyl-pent-4-enoyl)amino]butanoate

Systemtic Name: (phenylmethyl) (2S)-3-methyl-2-[(3-methyl-2,2-diphenyl-pent-4-enoyl)amino]butanoate Openeye Name: benzyl (2S)-3-methyl-2-[(3-methyl-2,2-diphenyl-pent-4-enoyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(3-methyl-1-oxo-2,2-diphenylpent-4-enyl)amino]butanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-3-methyl-2-[(3-methyl-2,2-diphenylpent-4-enoyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(3-methyl-2,2-diphenyl-pent-4-enoyl)amino]butyric acid benzyl ester Formula: C30H33NO3 MolecularWeight: 455.58792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC=CC=C1)NC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(C)C=C

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)C(C)C=C

InChI

InChI=1S/C30H33NO3/c1-5-23(4)30(25-17-11-7-12-18-25,26-19-13-8-14-20-26)29(33)31-27(22(2)3)28(32)34-21-24-15-9-6-10-16-24/h5-20,22-23,27H,1,21H2,2-4H3,(H,31,33)/t23?,27-/m0/s1