1-[(pentanoylamino)methyl]-2-[[6-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]naphthalen-2-yl]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(pentanoylamino)methyl]-2-[[6-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]naphthalen-2-yl]methyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[(pentanoylamino)methyl]-2-[[6-[2-(2H-tetrazol-5-yl)phenyl]-2-naphthyl]methyl]cyclohexanecarboxylic acid CAS Name: 1-[(1-oxopentylamino)methyl]-2-[[6-[2-(2H-tetrazol-5-yl)phenyl]-2-naphthalenyl]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(pentanoylamino)methyl]-2-[[6-[2-(2H-tetrazol-5-yl)phenyl]naphthalen-2-yl]methyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[[6-[2-(2H-tetrazol-5-yl)phenyl]-2-naphthyl]methyl]-1-[(valerylamino)methyl]cyclohexanecarboxylic acid Formula: C31H35N5O3 MolecularWeight: 525.6413

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NCC1(CCCCC1CC2=CC3=C(C=C2)C=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C(=O)O

Isomeric SMILES

CCCCC(=O)NCC1(CCCCC1CC2=CC3=C(C=C2)C=C(C=C3)C4=CC=CC=C4C5=NNN=N5)C(=O)O

InChI

InChI=1S/C31H35N5O3/c1-2-3-11-28(37)32-20-31(30(38)39)16-7-6-8-25(31)18-21-12-13-23-19-24(15-14-22(23)17-21)26-9-4-5-10-27(26)29-33-35-36-34-29/h4-5,9-10,12-15,17,19,25H,2-3,6-8,11,16,18,20H2,1H3,(H,32,37)(H,38,39)(H,33,34,35,36)