[[2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]-(1-phenylethyl)amino] ethanoate

Systemtic Name: [[2-azanyl-5-[bis(azanyl)methylideneamino]pentanoyl]-(1-phenylethyl)amino] ethanoate Openeye Name: [(2-amino-5-guanidino-pentanoyl)-(1-phenylethyl)amino] acetate CAS Name: acetic acid [[2-amino-5-(diaminomethylideneamino)-1-oxopentyl]-(1-phenylethyl)amino] ester IUPAC Name: [[2-amino-5-(diaminomethylideneamino)pentanoyl]-(1-phenylethyl)amino] acetate Traditional Name: acetic acid [(2-amino-5-guanidino-pentanoyl)-(1-phenylethyl)amino] ester Formula: C16H25N5O3 MolecularWeight: 335.4014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C(=O)C(CCCN=C(N)N)N)OC(=O)C

Isomeric SMILES

CC(C1=CC=CC=C1)N(C(=O)C(CCCN=C(N)N)N)OC(=O)C

InChI

InChI=1S/C16H25N5O3/c1-11(13-7-4-3-5-8-13)21(24-12(2)22)15(23)14(17)9-6-10-20-16(18)19/h3-5,7-8,11,14H,6,9-10,17H2,1-2H3,(H4,18,19,20)