tert-butyl N-[(2S)-1-[3,10-bis(oxidanylidene)hexadecyl-phenylmethoxy-amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S)-1-[3,10-bis(oxidanylidene)hexadecyl-phenylmethoxy-amino]-3-oxidanyl-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S)-2-[benzyloxy(3,10-dioxohexadecyl)amino]-1-(hydroxymethyl)-2-oxo-ethyl]carbamate CAS Name: N-[(2S)-1-[3,10-dioxohexadecyl(phenylmethoxy)amino]-3-hydroxy-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S)-1-[3,10-dioxohexadecyl(phenylmethoxy)amino]-3-hydroxy-1-oxopropan-2-yl]carbamate Traditional Name: N-[(1S)-2-[benzoxy(3,10-diketohexadecyl)amino]-2-keto-1-methylol-ethyl]carbamic acid tert-butyl ester Formula: C31H50N2O7 MolecularWeight: 562.7379

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CCCCCCC(=O)CCN(C(=O)C(CO)NC(=O)OC(C)(C)C)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCC(=O)CCCCCCC(=O)CCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)OCC1=CC=CC=C1

InChI

InChI=1S/C31H50N2O7/c1-5-6-7-13-18-26(35)19-14-8-9-15-20-27(36)21-22-33(39-24-25-16-11-10-12-17-25)29(37)28(23-34)32-30(38)40-31(2,3)4/h10-12,16-17,28,34H,5-9,13-15,18-24H2,1-4H3,(H,32,38)/t28-/m0/s1