N-[4-(dimethylamino)-3-(3-ethoxypropylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[4-(dimethylamino)-3-(3-ethoxypropylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[4-(dimethylamino)-3-(3-ethoxypropylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide CAS Name: N-[4-(dimethylamino)-3-[(3-ethoxypropylamino)-oxomethyl]phenyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-[4-(dimethylamino)-3-(3-ethoxypropylcarbamoyl)phenyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[4-(dimethylamino)-3-(3-ethoxypropylcarbamoyl)phenyl]-4-methyl-3-nitro-benzamide Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])N(C)C

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])N(C)C

InChI

InChI=1S/C22H28N4O5/c1-5-31-12-6-11-23-22(28)18-14-17(9-10-19(18)25(3)4)24-21(27)16-8-7-15(2)20(13-16)26(29)30/h7-10,13-14H,5-6,11-12H2,1-4H3,(H,23,28)(H,24,27)