1-[(4-methoxyphenyl)methyl]-3-(3-naphthalen-1-yloxyprop-1-ynyl)indole-2-carboxylic acid

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3-(3-naphthalen-1-yloxyprop-1-ynyl)indole-2-carboxylic acid Openeye Name: 1-[(4-methoxyphenyl)methyl]-3-[3-(1-naphthyloxy)prop-1-ynyl]indole-2-carboxylic acid CAS Name: 1-[(4-methoxyphenyl)methyl]-3-[3-(1-naphthalenyloxy)prop-1-ynyl]-2-indolecarboxylic acid IUPAC Name: 1-[(4-methoxyphenyl)methyl]-3-(3-naphthalen-1-yloxyprop-1-ynyl)indole-2-carboxylic acid Traditional Name: 3-[3-(1-naphthoxy)prop-1-ynyl]-1-p-anisyl-indole-2-carboxylic acid Formula: C30H23NO4 MolecularWeight: 461.50792

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2C(=O)O)C#CCOC4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=C2C(=O)O)C#CCOC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C30H23NO4/c1-34-23-17-15-21(16-18-23)20-31-27-13-5-4-11-25(27)26(29(31)30(32)33)12-7-19-35-28-14-6-9-22-8-2-3-10-24(22)28/h2-6,8-11,13-18H,19-20H2,1H3,(H,32,33)