methyl N-[4-[[3-[(2-nitrophenyl)amino]propanoylamino]methyl]phenyl]carbamate

Systemtic Name: methyl N-[4-[[3-[(2-nitrophenyl)amino]propanoylamino]methyl]phenyl]carbamate Openeye Name: methyl N-[4-[[3-(2-nitroanilino)propanoylamino]methyl]phenyl]carbamate CAS Name: N-[4-[[[3-(2-nitroanilino)-1-oxopropyl]amino]methyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[[3-(2-nitroanilino)propanoylamino]methyl]phenyl]carbamate Traditional Name: N-[4-[[3-(2-nitroanilino)propanoylamino]methyl]phenyl]carbamic acid methyl ester Formula: C18H20N4O5 MolecularWeight: 372.3752

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC1=CC=C(C=C1)CNC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COC(=O)NC1=CC=C(C=C1)CNC(=O)CCNC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O5/c1-27-18(24)21-14-8-6-13(7-9-14)12-20-17(23)10-11-19-15-4-2-3-5-16(15)22(25)26/h2-9,19H,10-12H2,1H3,(H,20,23)(H,21,24)