2-[(4-nitrophenyl)amino]ethyl-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium

Systemtic Name: 2-[(4-nitrophenyl)amino]ethyl-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Openeye Name: 2-(4-nitroanilino)ethyl-[[4-(2-thienylmethoxy)phenyl]methyl]ammonium CAS Name: 2-(4-nitroanilino)ethyl-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]ammonium IUPAC Name: 2-(4-nitroanilino)ethyl-[[4-(thiophen-2-ylmethoxy)phenyl]methyl]azanium Traditional Name: 2-(4-nitroanilino)ethyl-[4-(2-thenyloxy)benzyl]ammonium Formula: C20H22N3O3S+ MolecularWeight: 384.47198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)COC2=CC=C(C=C2)C[NH2+]CCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)COC2=CC=C(C=C2)C[NH2+]CCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O3S/c24-23(25)18-7-5-17(6-8-18)22-12-11-21-14-16-3-9-19(10-4-16)26-15-20-2-1-13-27-20/h1-10,13,21-22H,11-12,14-15H2/p+1