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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNCC(CCCN=C(N)N[N+](=O)[O-])N)N

Isomeric SMILES

C1=CC(=CC=C1CCNC[C@H](CCCN=C(N)N[N+](=O)[O-])N)N

InChI

InChI=1S/C14H25N7O2/c15-12-5-3-11(4-6-12)7-9-18-10-13(16)2-1-8-19-14(17)20-21(22)23/h3-6,13,18H,1-2,7-10,15-16H2,(H3,17,19,20)/t13-/m0/s1