5-azanyl-4-ethyl-N1-[(2-fluorophenyl)methyl]-6-phenyl-benzene-1,3-dicarboxamide hydrochloride

Systemtic Name: 5-azanyl-4-ethyl-N1-[(2-fluorophenyl)methyl]-6-phenyl-benzene-1,3-dicarboxamide hydrochloride Openeye Name: 5-amino-4-ethyl-N1-[(2-fluorophenyl)methyl]-6-phenyl-benzene-1,3-dicarboxamide hydrochloride CAS Name: 5-amino-4-ethyl-N1-[(2-fluorophenyl)methyl]-6-phenylbenzene-1,3-dicarboxamide hydrochloride IUPAC Name: 5-amino-4-ethyl-1-N-[(2-fluorophenyl)methyl]-6-phenylbenzene-1,3-dicarboxamide hydrochloride Traditional Name: 5-amino-4-ethyl-N-(2-fluorobenzyl)-6-phenyl-isophthalamide hydrochloride Formula: C23H23ClFN3O2 MolecularWeight: 427.899023

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1N)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3F)C(=O)N.Cl

Isomeric SMILES

CCC1=C(C=C(C(=C1N)C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3F)C(=O)N.Cl

InChI

InChI=1S/C23H22FN3O2.ClH/c1-2-16-17(22(26)28)12-18(20(21(16)25)14-8-4-3-5-9-14)23(29)27-13-15-10-6-7-11-19(15)24;/h3-12H,2,13,25H2,1H3,(H2,26,28)(H,27,29);1H