3-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-1-phenylmethoxy-naphthalene-2-carboxylic acid

Systemtic Name: 3-[2-[methyl(phenethyl)amino]-2-oxidanylidene-ethyl]-1-phenylmethoxy-naphthalene-2-carboxylic acid Openeye Name: 1-benzyloxy-3-[2-[methyl(phenethyl)amino]-2-oxo-ethyl]naphthalene-2-carboxylic acid CAS Name: 3-[2-[methyl(phenethyl)amino]-2-oxoethyl]-1-phenylmethoxy-2-naphthalenecarboxylic acid IUPAC Name: 3-[2-[methyl(phenethyl)amino]-2-oxoethyl]-1-phenylmethoxynaphthalene-2-carboxylic acid Traditional Name: 1-benzoxy-3-[2-keto-2-[methyl(phenethyl)amino]ethyl]-2-naphthoic acid Formula: C29H27NO4 MolecularWeight: 453.52898

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C(=O)CC2=CC3=CC=CC=C3C(=C2C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CN(CCC1=CC=CC=C1)C(=O)CC2=CC3=CC=CC=C3C(=C2C(=O)O)OCC4=CC=CC=C4

InChI

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