ethyl (2S)-2-[(3-benzamido-2,2-dimethyl-nonanoyl)amino]-3-phenyl-propanoate

Systemtic Name: ethyl (2S)-2-[(3-benzamido-2,2-dimethyl-nonanoyl)amino]-3-phenyl-propanoate Openeye Name: ethyl (2S)-2-[(3-benzamido-2,2-dimethyl-nonanoyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[(3-benzamido-2,2-dimethyl-1-oxononyl)amino]-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[(3-benzamido-2,2-dimethylnonanoyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(3-benzamido-2,2-dimethyl-nonanoyl)amino]-3-phenyl-propionic acid ethyl ester Formula: C29H40N2O4 MolecularWeight: 480.6389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(C)(C)C(=O)NC(CC1=CC=CC=C1)C(=O)OCC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC(C(C)(C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)OCC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C29H40N2O4/c1-5-7-8-15-20-25(31-26(32)23-18-13-10-14-19-23)29(3,4)28(34)30-24(27(33)35-6-2)21-22-16-11-9-12-17-22/h9-14,16-19,24-25H,5-8,15,20-21H2,1-4H3,(H,30,34)(H,31,32)/t24-,25?/m0/s1