sodium (2S,3S)-3-[[4-methyl-1-oxidanylidene-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]pentan-2-yl]carbamoyl]oxirane-2-carboxylate

Systemtic Name: sodium (2S,3S)-3-[[4-methyl-1-oxidanylidene-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]pentan-2-yl]carbamoyl]oxirane-2-carboxylate Openeye Name: sodium (2S,3S)-3-[[3-methyl-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1-carbonyl]butyl]carbamoyl]oxirane-2-carboxylate CAS Name: sodium (2S,3S)-3-[[[4-methyl-1-oxo-1-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]pentan-2-yl]amino]-oxomethyl]-2-oxiranecarboxylate IUPAC Name: sodium (2S,3S)-3-[[4-methyl-1-oxo-1-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]pentan-2-yl]carbamoyl]oxirane-2-carboxylate Traditional Name: sodium (2S,3S)-3-[[3-methyl-1-[4-(2,3,4-trimethoxybenzyl)piperazine-1-carbonyl]butyl]carbamoyl]oxirane-2-carboxylate Formula: C24H34N3NaO8 MolecularWeight: 515.53183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCN(CC1)CC2=C(C(=C(C=C2)OC)OC)OC)NC(=O)C3C(O3)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)CC(C(=O)N1CCN(CC1)CC2=C(C(=C(C=C2)OC)OC)OC)NC(=O)[C@@H]3[C@H](O3)C(=O)[O-].[Na+]

InChI

InChI=1S/C24H35N3O8.Na/c1-14(2)12-16(25-22(28)20-21(35-20)24(30)31)23(29)27-10-8-26(9-11-27)13-15-6-7-17(32-3)19(34-5)18(15)33-4;/h6-7,14,16,20-21H,8-13H2,1-5H3,(H,25,28)(H,30,31);/q;+1/p-1/t16?,20-,21-;/m0./s1