disodium (4S)-4-azanyl-5-[[(2S)-3-(1H-indol-3-yl)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate

Systemtic Name: disodium (4S)-4-azanyl-5-[[(2S)-3-(1H-indol-3-yl)-1-oxidanidyl-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoate Openeye Name: disodium (4S)-4-amino-5-[[(1S)-1-(1H-indol-3-ylmethyl)-2-oxido-2-oxo-ethyl]amino]-5-oxo-pentanoate CAS Name: disodium (4S)-4-amino-5-[[(2S)-3-(1H-indol-3-yl)-1-oxido-1-oxopropan-2-yl]amino]-5-oxopentanoate IUPAC Name: disodium (4S)-4-amino-5-[[(2S)-3-(1H-indol-3-yl)-1-oxido-1-oxopropan-2-yl]amino]-5-oxopentanoate Traditional Name: disodium (4S)-4-amino-5-[[(1S)-1-(1H-indol-3-ylmethyl)-2-keto-2-oxido-ethyl]amino]-5-keto-valerate Formula: C16H17N3Na2O5 MolecularWeight: 377.30282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)[O-])NC(=O)C(CCC(=O)[O-])N.[Na+].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@@H](C(=O)[O-])NC(=O)[C@H](CCC(=O)[O-])N.[Na+].[Na+]

InChI

InChI=1S/C16H19N3O5.2Na/c17-11(5-6-14(20)21)15(22)19-13(16(23)24)7-9-8-18-12-4-2-1-3-10(9)12;;/h1-4,8,11,13,18H,5-7,17H2,(H,19,22)(H,20,21)(H,23,24);;/q;2*+1/p-2/t11-,13-;;/m0../s1