ethyl 4-[[(2S)-2-[(2-benzamidophenyl)carbonylamino]butanoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(2S)-2-[(2-benzamidophenyl)carbonylamino]butanoyl]amino]benzoate Openeye Name: ethyl 4-[[(2S)-2-[(2-benzamidobenzoyl)amino]butanoyl]amino]benzoate CAS Name: 4-[[(2S)-2-[[(2-benzamidophenyl)-oxomethyl]amino]-1-oxobutyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(2S)-2-[(2-benzamidobenzoyl)amino]butanoyl]amino]benzoate Traditional Name: 4-[[(2S)-2-[(2-benzamidobenzoyl)amino]butanoyl]amino]benzoic acid ethyl ester Formula: C27H27N3O5 MolecularWeight: 473.52038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)NC(=O)C2=CC=CC=C2NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC[C@@H](C(=O)NC1=CC=C(C=C1)C(=O)OCC)NC(=O)C2=CC=CC=C2NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H27N3O5/c1-3-22(26(33)28-20-16-14-19(15-17-20)27(34)35-4-2)29-25(32)21-12-8-9-13-23(21)30-24(31)18-10-6-5-7-11-18/h5-17,22H,3-4H2,1-2H3,(H,28,33)(H,29,32)(H,30,31)/t22-/m0/s1