tert-butyl N-[(2S,4S)-4-azanyl-7-[bis(azanyl)methylideneamino]-4-methanoyl-1-oxidanyl-3-oxidanylidene-heptan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,4S)-4-azanyl-7-[bis(azanyl)methylideneamino]-4-methanoyl-1-oxidanyl-3-oxidanylidene-heptan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,3S)-3-amino-3-formyl-6-guanidino-1-(hydroxymethyl)-2-oxo-hexyl]carbamate CAS Name: N-[(2S,4S)-4-amino-7-(diaminomethylideneamino)-4-formyl-1-hydroxy-3-oxoheptan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,4S)-4-amino-7-(diaminomethylideneamino)-4-formyl-1-hydroxy-3-oxoheptan-2-yl]carbamate Traditional Name: N-[(1S,3S)-3-amino-3-formyl-6-guanidino-2-keto-1-methylol-hexyl]carbamic acid tert-butyl ester Formula: C14H27N5O5 MolecularWeight: 345.39468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CO)C(=O)C(CCCN=C(N)N)(C=O)N

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CO)C(=O)[C@](CCCN=C(N)N)(C=O)N

InChI

InChI=1S/C14H27N5O5/c1-13(2,3)24-12(23)19-9(7-20)10(22)14(17,8-21)5-4-6-18-11(15)16/h8-9,20H,4-7,17H2,1-3H3,(H,19,23)(H4,15,16,18)/t9-,14-/m0/s1