3-[(4-imidazol-1-yl-2-nitro-phenyl)amino]-N-[3-[methyl(phenyl)amino]propyl]propanamide

Systemtic Name: 3-[(4-imidazol-1-yl-2-nitro-phenyl)amino]-N-[3-[methyl(phenyl)amino]propyl]propanamide Openeye Name: 3-(4-imidazol-1-yl-2-nitro-anilino)-N-[3-(N-methylanilino)propyl]propanamide CAS Name: 3-[4-(1-imidazolyl)-2-nitroanilino]-N-[3-(N-methylanilino)propyl]propanamide IUPAC Name: 3-(4-imidazol-1-yl-2-nitroanilino)-N-[3-(N-methylanilino)propyl]propanamide Traditional Name: 3-(4-imidazol-1-yl-2-nitro-anilino)-N-[3-(N-methylanilino)propyl]propionamide Formula: C22H26N6O3 MolecularWeight: 422.48024

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)CCNC1=C(C=C(C=C1)N2C=CN=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)CCNC1=C(C=C(C=C1)N2C=CN=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C22H26N6O3/c1-26(18-6-3-2-4-7-18)14-5-11-25-22(29)10-12-24-20-9-8-19(16-21(20)28(30)31)27-15-13-23-17-27/h2-4,6-9,13,15-17,24H,5,10-12,14H2,1H3,(H,25,29)