2-[[2-[(5-methyl-2-naphthalen-1-yl-hexanoyl)amino]phenyl]methyl]benzoic acid

Systemtic Name: 2-[[2-[(5-methyl-2-naphthalen-1-yl-hexanoyl)amino]phenyl]methyl]benzoic acid Openeye Name: 2-[[2-[[5-methyl-2-(1-naphthyl)hexanoyl]amino]phenyl]methyl]benzoic acid CAS Name: 2-[[2-[[5-methyl-2-(1-naphthalenyl)-1-oxohexyl]amino]phenyl]methyl]benzoic acid IUPAC Name: 2-[[2-[(5-methyl-2-naphthalen-1-ylhexanoyl)amino]phenyl]methyl]benzoic acid Traditional Name: 2-[2-[[5-methyl-2-(1-naphthyl)hexanoyl]amino]benzyl]benzoic acid Formula: C31H31NO3 MolecularWeight: 465.58274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3CC4=CC=CC=C4C(=O)O

Isomeric SMILES

CC(C)CCC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=CC=CC=C3CC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C31H31NO3/c1-21(2)18-19-28(27-16-9-13-22-10-3-6-14-25(22)27)30(33)32-29-17-8-5-12-24(29)20-23-11-4-7-15-26(23)31(34)35/h3-17,21,28H,18-20H2,1-2H3,(H,32,33)(H,34,35)