6-[2-[2-(2-azanylethanoylamino)ethanoylamino]ethanoylamino]-2-(phenylmethoxycarbonylamino)hexanoic acid

Systemtic Name: 6-[2-[2-(2-azanylethanoylamino)ethanoylamino]ethanoylamino]-2-(phenylmethoxycarbonylamino)hexanoic acid Openeye Name: 6-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]-2-(benzyloxycarbonylamino)hexanoic acid CAS Name: 6-[[2-[[2-[(2-amino-1-oxoethyl)amino]-1-oxoethyl]amino]-1-oxoethyl]amino]-2-(phenylmethoxycarbonylamino)hexanoic acid IUPAC Name: 6-[[2-[[2-[(2-aminoacetyl)amino]acetyl]amino]acetyl]amino]-2-(phenylmethoxycarbonylamino)hexanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-6-[[2-[[2-(glycylamino)acetyl]amino]acetyl]amino]hexanoic acid Formula: C20H29N5O7 MolecularWeight: 451.47356

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCCNC(=O)CNC(=O)CNC(=O)CN)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCCNC(=O)CNC(=O)CNC(=O)CN)C(=O)O

InChI

InChI=1S/C20H29N5O7/c21-10-16(26)23-12-18(28)24-11-17(27)22-9-5-4-8-15(19(29)30)25-20(31)32-13-14-6-2-1-3-7-14/h1-3,6-7,15H,4-5,8-13,21H2,(H,22,27)(H,23,26)(H,24,28)(H,25,31)(H,29,30)