2,3-bis[(2S)-2-azanyl-3-phenyl-propanoyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-2-carboxylic acid

Systemtic Name: 2,3-bis[(2S)-2-azanyl-3-phenyl-propanoyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-2-carboxylic acid Openeye Name: 2,3-bis[(2S)-2-amino-3-phenyl-propanoyl]-1-tert-butoxycarbonyl-azetidine-2-carboxylic acid CAS Name: 2,3-bis[(2S)-2-amino-1-oxo-3-phenylpropyl]-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-azetidinecarboxylic acid IUPAC Name: 2,3-bis[(2S)-2-amino-3-phenylpropanoyl]-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidine-2-carboxylic acid Traditional Name: 2,3-bis[(2S)-2-amino-3-phenyl-propanoyl]-1-tert-butoxycarbonyl-azetidine-2-carboxylic acid Formula: C27H33N3O6 MolecularWeight: 495.56742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(C1(C(=O)C(CC2=CC=CC=C2)N)C(=O)O)C(=O)C(CC3=CC=CC=C3)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(C1(C(=O)[C@H](CC2=CC=CC=C2)N)C(=O)O)C(=O)[C@H](CC3=CC=CC=C3)N

InChI

InChI=1S/C27H33N3O6/c1-26(2,3)36-25(35)30-16-19(22(31)20(28)14-17-10-6-4-7-11-17)27(30,24(33)34)23(32)21(29)15-18-12-8-5-9-13-18/h4-13,19-21H,14-16,28-29H2,1-3H3,(H,33,34)/t19?,20-,21-,27?/m0/s1