methyl (2S)-3-[4-[[2-azanyl-5-(dimethylamino)phenyl]carbonylamino]phenyl]-2-[[2,6-bis(chloranyl)phenyl]carbonylamino]propanoate

Systemtic Name: methyl (2S)-3-[4-[[2-azanyl-5-(dimethylamino)phenyl]carbonylamino]phenyl]-2-[[2,6-bis(chloranyl)phenyl]carbonylamino]propanoate Openeye Name: methyl (2S)-3-[4-[[2-amino-5-(dimethylamino)benzoyl]amino]phenyl]-2-[(2,6-dichlorobenzoyl)amino]propanoate CAS Name: (2S)-3-[4-[[[2-amino-5-(dimethylamino)phenyl]-oxomethyl]amino]phenyl]-2-[[(2,6-dichlorophenyl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-[4-[[2-amino-5-(dimethylamino)benzoyl]amino]phenyl]-2-[(2,6-dichlorobenzoyl)amino]propanoate Traditional Name: (2S)-3-[4-[[2-amino-5-(dimethylamino)benzoyl]amino]phenyl]-2-[(2,6-dichlorobenzoyl)amino]propionic acid methyl ester Formula: C26H26Cl2N4O4 MolecularWeight: 529.41504

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1)N)C(=O)NC2=CC=C(C=C2)CC(C(=O)OC)NC(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CN(C)C1=CC(=C(C=C1)N)C(=O)NC2=CC=C(C=C2)C[C@@H](C(=O)OC)NC(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C26H26Cl2N4O4/c1-32(2)17-11-12-21(29)18(14-17)24(33)30-16-9-7-15(8-10-16)13-22(26(35)36-3)31-25(34)23-19(27)5-4-6-20(23)28/h4-12,14,22H,13,29H2,1-3H3,(H,30,33)(H,31,34)/t22-/m0/s1