N-[3-[2-[(3-methoxy-4-nitro-phenyl)carbonyl-methyl-amino]-5-methyl-phenoxy]propyl]-4-methyl-piperazine-1-carboxamide

Systemtic Name: N-[3-[2-[(3-methoxy-4-nitro-phenyl)carbonyl-methyl-amino]-5-methyl-phenoxy]propyl]-4-methyl-piperazine-1-carboxamide Openeye Name: N-[3-[2-[(3-methoxy-4-nitro-benzoyl)-methyl-amino]-5-methyl-phenoxy]propyl]-4-methyl-piperazine-1-carboxamide CAS Name: N-[3-[2-[[(3-methoxy-4-nitrophenyl)-oxomethyl]-methylamino]-5-methylphenoxy]propyl]-4-methyl-1-piperazinecarboxamide IUPAC Name: N-[3-[2-[(3-methoxy-4-nitrobenzoyl)-methylamino]-5-methylphenoxy]propyl]-4-methylpiperazine-1-carboxamide Traditional Name: N-[3-[2-[(3-methoxy-4-nitro-benzoyl)-methyl-amino]-5-methyl-phenoxy]propyl]-4-methyl-piperazine-1-carboxamide Formula: C25H33N5O6 MolecularWeight: 499.55942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])OC)OCCCNC(=O)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(C)C(=O)C2=CC(=C(C=C2)[N+](=O)[O-])OC)OCCCNC(=O)N3CCN(CC3)C

InChI

InChI=1S/C25H33N5O6/c1-18-6-8-20(28(3)24(31)19-7-9-21(30(33)34)22(17-19)35-4)23(16-18)36-15-5-10-26-25(32)29-13-11-27(2)12-14-29/h6-9,16-17H,5,10-15H2,1-4H3,(H,26,32)