disodium 2-[[4-methyl-1-[(1-oxidanidyl-1-oxidanylidene-propan-2-yl)-(4-phenylphenyl)amino]-1-oxidanylidene-pentan-2-yl]amino]-3-phenyl-propanoate

Systemtic Name: disodium 2-[[4-methyl-1-[(1-oxidanidyl-1-oxidanylidene-propan-2-yl)-(4-phenylphenyl)amino]-1-oxidanylidene-pentan-2-yl]amino]-3-phenyl-propanoate Openeye Name: disodium 2-[[3-methyl-1-[(1-methyl-2-oxido-2-oxo-ethyl)-(4-phenylphenyl)carbamoyl]butyl]amino]-3-phenyl-propanoate CAS Name: disodium 2-[[4-methyl-1-(N-(1-oxido-1-oxopropan-2-yl)-4-phenylanilino)-1-oxopentan-2-yl]amino]-3-phenylpropanoate IUPAC Name: disodium 2-[[4-methyl-1-(N-(1-oxido-1-oxopropan-2-yl)-4-phenylanilino)-1-oxopentan-2-yl]amino]-3-phenylpropanoate Traditional Name: disodium 2-[[1-[(2-keto-1-methyl-2-oxido-ethyl)-(4-phenylphenyl)carbamoyl]-3-methyl-butyl]amino]-3-phenyl-propionate Formula: C30H32N2Na2O5 MolecularWeight: 546.56502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2)C(C)C(=O)[O-])NC(CC3=CC=CC=C3)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC(C)CC(C(=O)N(C1=CC=C(C=C1)C2=CC=CC=C2)C(C)C(=O)[O-])NC(CC3=CC=CC=C3)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C30H34N2O5.2Na/c1-20(2)18-26(31-27(30(36)37)19-22-10-6-4-7-11-22)28(33)32(21(3)29(34)35)25-16-14-24(15-17-25)23-12-8-5-9-13-23;;/h4-17,20-21,26-27,31H,18-19H2,1-3H3,(H,34,35)(H,36,37);;/q;2*+1/p-2