N-[(4-methylphenyl)methyl]-4-morpholin-4-yl-3-nitro-N-propyl-benzamide

Systemtic Name: N-[(4-methylphenyl)methyl]-4-morpholin-4-yl-3-nitro-N-propyl-benzamide Openeye Name: 4-morpholino-3-nitro-N-propyl-N-(p-tolylmethyl)benzamide CAS Name: N-[(4-methylphenyl)methyl]-4-(4-morpholinyl)-3-nitro-N-propylbenzamide IUPAC Name: N-[(4-methylphenyl)methyl]-4-morpholin-4-yl-3-nitro-N-propylbenzamide Traditional Name: N-(4-methylbenzyl)-4-morpholino-3-nitro-N-propyl-benzamide Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=CC=C(C=C1)C)C(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CCCN(CC1=CC=C(C=C1)C)C(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O4/c1-3-10-24(16-18-6-4-17(2)5-7-18)22(26)19-8-9-20(21(15-19)25(27)28)23-11-13-29-14-12-23/h4-9,15H,3,10-14,16H2,1-2H3