4-[[5-(6-methoxynaphthalen-2-yl)-3-oxidanylidene-1-phenyl-pentyl]amino]benzoic acid

Systemtic Name: 4-[[5-(6-methoxynaphthalen-2-yl)-3-oxidanylidene-1-phenyl-pentyl]amino]benzoic acid Openeye Name: 4-[[5-(6-methoxy-2-naphthyl)-3-oxo-1-phenyl-pentyl]amino]benzoic acid CAS Name: 4-[[5-(6-methoxy-2-naphthalenyl)-3-oxo-1-phenylpentyl]amino]benzoic acid IUPAC Name: 4-[[5-(6-methoxynaphthalen-2-yl)-3-oxo-1-phenylpentyl]amino]benzoic acid Traditional Name: 4-[[3-keto-5-(6-methoxy-2-naphthyl)-1-phenyl-pentyl]amino]benzoic acid Formula: C29H27NO4 MolecularWeight: 453.52898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C=C(C=C2)CCC(=O)CC(C3=CC=CC=C3)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C=C(C=C2)CCC(=O)CC(C3=CC=CC=C3)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C29H27NO4/c1-34-27-16-12-23-17-20(7-9-24(23)18-27)8-15-26(31)19-28(21-5-3-2-4-6-21)30-25-13-10-22(11-14-25)29(32)33/h2-7,9-14,16-18,28,30H,8,15,19H2,1H3,(H,32,33)