N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxidanylidenechromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-hexyl-benzamide

Systemtic Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxidanylidenechromen-3-yl)methyl]amino]-2-oxidanylidene-ethyl]-4-hexyl-benzamide Openeye Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxo-ethyl]-4-hexyl-benzamide CAS Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxo-1-benzopyran-3-yl)methyl]amino]-2-oxoethyl]-4-hexylbenzamide IUPAC Name: N-butyl-N-[2-[(4-fluorophenyl)methyl-[(4-oxochromen-3-yl)methyl]amino]-2-oxoethyl]-4-hexylbenzamide Traditional Name: N-butyl-N-[2-[(4-fluorobenzyl)-[(4-ketochromen-3-yl)methyl]amino]-2-keto-ethyl]-4-hexyl-benzamide Formula: C36H41FN2O4 MolecularWeight: 584.720143

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)N(CC2=CC=C(C=C2)F)CC3=COC4=CC=CC=C4C3=O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCC)CC(=O)N(CC2=CC=C(C=C2)F)CC3=COC4=CC=CC=C4C3=O

InChI

InChI=1S/C36H41FN2O4/c1-3-5-7-8-11-27-14-18-29(19-15-27)36(42)38(22-6-4-2)25-34(40)39(23-28-16-20-31(37)21-17-28)24-30-26-43-33-13-10-9-12-32(33)35(30)41/h9-10,12-21,26H,3-8,11,22-25H2,1-2H3