N-[2-(4-aminophenyl)ethyl]-N-[3-(2-azanyl-3-nitro-phenoxy)-2-oxidanyl-propyl]carbamate

Systemtic Name: N-[2-(4-aminophenyl)ethyl]-N-[3-(2-azanyl-3-nitro-phenoxy)-2-oxidanyl-propyl]carbamate Openeye Name: N-[3-(2-amino-3-nitro-phenoxy)-2-hydroxy-propyl]-N-[2-(4-aminophenyl)ethyl]carbamate CAS Name: N-[3-(2-amino-3-nitrophenoxy)-2-hydroxypropyl]-N-[2-(4-aminophenyl)ethyl]carbamate IUPAC Name: N-[3-(2-amino-3-nitrophenoxy)-2-hydroxypropyl]-N-[2-(4-aminophenyl)ethyl]carbamate Traditional Name: N-[3-(2-amino-3-nitro-phenoxy)-2-hydroxy-propyl]-N-[2-(4-aminophenyl)ethyl]carbamate Formula: C18H21N4O6- MolecularWeight: 389.38254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OCC(CN(CCC2=CC=C(C=C2)N)C(=O)[O-])O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)OCC(CN(CCC2=CC=C(C=C2)N)C(=O)[O-])O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O6/c19-13-6-4-12(5-7-13)8-9-21(18(24)25)10-14(23)11-28-16-3-1-2-15(17(16)20)22(26)27/h1-7,14,23H,8-11,19-20H2,(H,24,25)/p-1