2-[(4S)-5-[2-(3-aminophenyl)ethylamino]-4-azanyl-pentyl]-1-nitro-guanidine

Systemtic Name: 2-[(4S)-5-[2-(3-aminophenyl)ethylamino]-4-azanyl-pentyl]-1-nitro-guanidine Openeye Name: 2-[(4S)-4-amino-5-[2-(3-aminophenyl)ethylamino]pentyl]-1-nitro-guanidine CAS Name: 2-[(4S)-4-amino-5-[2-(3-aminophenyl)ethylamino]pentyl]-1-nitroguanidine IUPAC Name: 2-[(4S)-4-amino-5-[2-(3-aminophenyl)ethylamino]pentyl]-1-nitroguanidine Traditional Name: 2-[(4S)-4-amino-5-[2-(3-aminophenyl)ethylamino]pentyl]-1-nitro-guanidine Formula: C14H25N7O2 MolecularWeight: 323.394

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)CCNCC(CCCN=C(N)N[N+](=O)[O-])N

Isomeric SMILES

C1=CC(=CC(=C1)N)CCNC[C@H](CCCN=C(N)N[N+](=O)[O-])N

InChI

InChI=1S/C14H25N7O2/c15-12-4-1-3-11(9-12)6-8-18-10-13(16)5-2-7-19-14(17)20-21(22)23/h1,3-4,9,13,18H,2,5-8,10,15-16H2,(H3,17,19,20)/t13-/m0/s1