4-[propyl-(5,5,8-trimethyl-3-phenylmethoxy-6H-naphthalen-2-yl)amino]benzoic acid

Systemtic Name: 4-[propyl-(5,5,8-trimethyl-3-phenylmethoxy-6H-naphthalen-2-yl)amino]benzoic acid Openeye Name: 4-[(3-benzyloxy-5,5,8-trimethyl-6H-naphthalen-2-yl)-propyl-amino]benzoic acid CAS Name: 4-[propyl-(5,5,8-trimethyl-3-phenylmethoxy-6H-naphthalen-2-yl)amino]benzoic acid IUPAC Name: 4-[propyl-(5,5,8-trimethyl-3-phenylmethoxy-6H-naphthalen-2-yl)amino]benzoic acid Traditional Name: 4-[(3-benzoxy-5,5,8-trimethyl-6H-naphthalen-2-yl)-propyl-amino]benzoic acid Formula: C30H33NO3 MolecularWeight: 455.58792

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=C(C=C1)C(=O)O)C2=C(C=C3C(=C2)C(=CCC3(C)C)C)OCC4=CC=CC=C4

Isomeric SMILES

CCCN(C1=CC=C(C=C1)C(=O)O)C2=C(C=C3C(=C2)C(=CCC3(C)C)C)OCC4=CC=CC=C4

InChI

InChI=1S/C30H33NO3/c1-5-17-31(24-13-11-23(12-14-24)29(32)33)27-18-25-21(2)15-16-30(3,4)26(25)19-28(27)34-20-22-9-7-6-8-10-22/h6-15,18-19H,5,16-17,20H2,1-4H3,(H,32,33)