3-[3-cyclohexylpropanoyl-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]amino]benzoic acid

Systemtic Name: 3-[3-cyclohexylpropanoyl-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]amino]benzoic acid Openeye Name: 3-[3-cyclohexylpropanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]benzoic acid CAS Name: 3-[(3-cyclohexyl-1-oxopropyl)-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]benzoic acid IUPAC Name: 3-[3-cyclohexylpropanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]benzoic acid Traditional Name: 3-[3-cyclohexylpropanoyl-[4-[2-(2H-tetrazol-5-yl)phenyl]benzyl]amino]benzoic acid Formula: C30H31N5O3 MolecularWeight: 509.59884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)N(CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)C5=CC=CC(=C5)C(=O)O

Isomeric SMILES

C1CCC(CC1)CCC(=O)N(CC2=CC=C(C=C2)C3=CC=CC=C3C4=NNN=N4)C5=CC=CC(=C5)C(=O)O

InChI

InChI=1S/C30H31N5O3/c36-28(18-15-21-7-2-1-3-8-21)35(25-10-6-9-24(19-25)30(37)38)20-22-13-16-23(17-14-22)26-11-4-5-12-27(26)29-31-33-34-32-29/h4-6,9-14,16-17,19,21H,1-3,7-8,15,18,20H2,(H,37,38)(H,31,32,33,34)