tert-butyl (2S,3R)-5-[bis(azanyl)methylideneamino]-3-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: tert-butyl (2S,3R)-5-[bis(azanyl)methylideneamino]-3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: tert-butyl (2S,3R)-2-(benzyloxycarbonylamino)-5-guanidino-3-methyl-pentanoate CAS Name: (2S,3R)-5-(diaminomethylideneamino)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3R)-5-(diaminomethylideneamino)-3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: (2S,3R)-2-(benzyloxycarbonylamino)-5-guanidino-3-methyl-valeric acid tert-butyl ester Formula: C19H30N4O4 MolecularWeight: 378.4659

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN=C(N)N)C(C(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C19H30N4O4/c1-13(10-11-22-17(20)21)15(16(24)27-19(2,3)4)23-18(25)26-12-14-8-6-5-7-9-14/h5-9,13,15H,10-12H2,1-4H3,(H,23,25)(H4,20,21,22)/t13-,15+/m1/s1