(3-carboxy-6-phenylmethoxy-naphthalen-1-yl)-ethanoyl-methyl-phenethyl-azanium

Systemtic Name: (3-carboxy-6-phenylmethoxy-naphthalen-1-yl)-ethanoyl-methyl-phenethyl-azanium Openeye Name: acetyl-(6-benzyloxy-3-carboxy-1-naphthyl)-methyl-phenethyl-ammonium CAS Name: acetyl-(3-carboxy-6-phenylmethoxy-1-naphthalenyl)-methyl-phenethylammonium IUPAC Name: acetyl-(3-carboxy-6-phenylmethoxynaphthalen-1-yl)-methyl-phenethylazanium Traditional Name: acetyl-(6-benzoxy-3-carboxy-1-naphthyl)-methyl-phenethyl-ammonium Formula: C29H28NO4+ MolecularWeight: 454.53692

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[N+](C)(CCC1=CC=CC=C1)C2=C3C=CC(=CC3=CC(=C2)C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CC(=O)[N+](C)(CCC1=CC=CC=C1)C2=C3C=CC(=CC3=CC(=C2)C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C29H27NO4/c1-21(31)30(2,16-15-22-9-5-3-6-10-22)28-19-25(29(32)33)17-24-18-26(13-14-27(24)28)34-20-23-11-7-4-8-12-23/h3-14,17-19H,15-16,20H2,1-2H3/p+1