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

Systemtic Name: 2-[(4S)-5-[(3-aminophenyl)amino]-4-azanyl-pentyl]-1-nitro-guanidine Openeye Name: 2-[(4S)-4-amino-5-(3-aminoanilino)pentyl]-1-nitro-guanidine CAS Name: 2-[(4S)-4-amino-5-(3-aminoanilino)pentyl]-1-nitroguanidine IUPAC Name: 2-[(4S)-4-amino-5-(3-aminoanilino)pentyl]-1-nitroguanidine Traditional Name: 2-[(4S)-4-amino-5-(3-aminoanilino)pentyl]-1-nitro-guanidine Formula: C12H21N7O2 MolecularWeight: 295.34084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H21N7O2/c13-9-3-1-5-11(7-9)17-8-10(14)4-2-6-16-12(15)18-19(20)21/h1,3,5,7,10,17H,2,4,6,8,13-14H2,(H3,15,16,18)/t10-/m0/s1