4-[[4-[bis(azanyl)methylideneamino]phenyl]methylcarbamoyl]piperazine-1-carboxylate

Systemtic Name: 4-[[4-[bis(azanyl)methylideneamino]phenyl]methylcarbamoyl]piperazine-1-carboxylate Openeye Name: 4-[(4-guanidinophenyl)methylcarbamoyl]piperazine-1-carboxylate CAS Name: 4-[[[4-(diaminomethylideneamino)phenyl]methylamino]-oxomethyl]-1-piperazinecarboxylate IUPAC Name: 4-[[4-(diaminomethylideneamino)phenyl]methylcarbamoyl]piperazine-1-carboxylate Traditional Name: 4-[(4-guanidinobenzyl)carbamoyl]piperazine-1-carboxylate Formula: C14H19N6O3- MolecularWeight: 319.33906

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)NCC2=CC=C(C=C2)N=C(N)N)C(=O)[O-]

Isomeric SMILES

C1CN(CCN1C(=O)NCC2=CC=C(C=C2)N=C(N)N)C(=O)[O-]

InChI

InChI=1S/C14H20N6O3/c15-12(16)18-11-3-1-10(2-4-11)9-17-13(21)19-5-7-20(8-6-19)14(22)23/h1-4H,5-9H2,(H,17,21)(H,22,23)(H4,15,16,18)/p-1