5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-[1-oxidanylidene-1-[(phenylmethyl)amino]hexadecan-3-yl]oxy-hexanoic acid

Systemtic Name: 5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-6-[1-oxidanylidene-1-[(phenylmethyl)amino]hexadecan-3-yl]oxy-hexanoic acid Openeye Name: 6-[1-[2-(benzylamino)-2-oxo-ethyl]tetradecoxy]-5-(tert-butoxycarbonylamino)-6-oxo-hexanoic acid CAS Name: 5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxo-6-[1-oxo-1-[(phenylmethyl)amino]hexadecan-3-yl]oxyhexanoic acid IUPAC Name: 6-[1-(benzylamino)-1-oxohexadecan-3-yl]oxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexanoic acid Traditional Name: 6-[1-[2-(benzylamino)-2-keto-ethyl]tetradecoxy]-5-(tert-butoxycarbonylamino)-6-keto-hexanoic acid Formula: C34H56N2O7 MolecularWeight: 604.81764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)NCC1=CC=CC=C1)OC(=O)C(CCCC(=O)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)NCC1=CC=CC=C1)OC(=O)C(CCCC(=O)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C34H56N2O7/c1-5-6-7-8-9-10-11-12-13-14-18-22-28(25-30(37)35-26-27-20-16-15-17-21-27)42-32(40)29(23-19-24-31(38)39)36-33(41)43-34(2,3)4/h15-17,20-21,28-29H,5-14,18-19,22-26H2,1-4H3,(H,35,37)(H,36,41)(H,38,39)