N-(3-azanylpropyl)-N-[(4-fluorophenyl)methyl]-3-nitro-4-phenylmethoxy-benzamide

Systemtic Name: N-(3-azanylpropyl)-N-[(4-fluorophenyl)methyl]-3-nitro-4-phenylmethoxy-benzamide Openeye Name: N-(3-aminopropyl)-4-benzyloxy-N-[(4-fluorophenyl)methyl]-3-nitro-benzamide CAS Name: N-(3-aminopropyl)-N-[(4-fluorophenyl)methyl]-3-nitro-4-phenylmethoxybenzamide IUPAC Name: N-(3-aminopropyl)-N-[(4-fluorophenyl)methyl]-3-nitro-4-phenylmethoxybenzamide Traditional Name: N-(3-aminopropyl)-4-benzoxy-N-(4-fluorobenzyl)-3-nitro-benzamide Formula: C24H24FN3O4 MolecularWeight: 437.463463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(=O)N(CCCN)CC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C=C(C=C2)C(=O)N(CCCN)CC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C24H24FN3O4/c25-21-10-7-18(8-11-21)16-27(14-4-13-26)24(29)20-9-12-23(22(15-20)28(30)31)32-17-19-5-2-1-3-6-19/h1-3,5-12,15H,4,13-14,16-17,26H2