N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-morpholin-4-yl-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-morpholino-3-nitro-benzamide CAS Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-cyclopropyl-N-(4-fluorobenzyl)-4-morpholino-3-nitro-benzamide Formula: C21H22FN3O4 MolecularWeight: 399.415483

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=C(C=C2)F)C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CC1N(CC2=CC=C(C=C2)F)C(=O)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H22FN3O4/c22-17-4-1-15(2-5-17)14-24(18-6-7-18)21(26)16-3-8-19(20(13-16)25(27)28)23-9-11-29-12-10-23/h1-5,8,13,18H,6-7,9-12,14H2