cyclododecyl (3S)-3-azanyl-4-[[(2S)-1-azanyl-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: cyclododecyl (3S)-3-azanyl-4-[[(2S)-1-azanyl-1-oxidanylidene-3-phenylmethoxy-propan-2-yl]amino]-4-oxidanylidene-butanoate Openeye Name: cyclododecyl (3S)-3-amino-4-[[(1S)-2-amino-1-(benzyloxymethyl)-2-oxo-ethyl]amino]-4-oxo-butanoate CAS Name: (3S)-3-amino-4-[[(2S)-1-amino-1-oxo-3-phenylmethoxypropan-2-yl]amino]-4-oxobutanoic acid cyclododecyl ester IUPAC Name: cyclododecyl (3S)-3-amino-4-[[(2S)-1-amino-1-oxo-3-phenylmethoxypropan-2-yl]amino]-4-oxobutanoate Traditional Name: (3S)-3-amino-4-[[(1S)-2-amino-1-(benzoxymethyl)-2-keto-ethyl]amino]-4-keto-butyric acid cyclododecyl ester Formula: C26H41N3O5 MolecularWeight: 475.62084

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)OC(=O)CC(C(=O)NC(COCC2=CC=CC=C2)C(=O)N)N

Isomeric SMILES

C1CCCCCC(CCCCC1)OC(=O)C[C@@H](C(=O)N[C@@H](COCC2=CC=CC=C2)C(=O)N)N

InChI

InChI=1S/C26H41N3O5/c27-22(17-24(30)34-21-15-11-6-4-2-1-3-5-7-12-16-21)26(32)29-23(25(28)31)19-33-18-20-13-9-8-10-14-20/h8-10,13-14,21-23H,1-7,11-12,15-19,27H2,(H2,28,31)(H,29,32)/t22-,23-/m0/s1