(phenylmethyl) N-[1-azanyl-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-azanyl-5-[bis(azanyl)methylideneamino]-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-(1-carbamoyl-4-guanidino-butyl)carbamate CAS Name: N-[1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]carbamate Traditional Name: N-(1-carbamoyl-4-guanidino-butyl)carbamic acid benzyl ester Formula: C14H21N5O3 MolecularWeight: 307.34824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCCN=C(N)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCCN=C(N)N)C(=O)N

InChI

InChI=1S/C14H21N5O3/c15-12(20)11(7-4-8-18-13(16)17)19-14(21)22-9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9H2,(H2,15,20)(H,19,21)(H4,16,17,18)