2-[3-(4-azanylbutyl)-2-(1-methoxynaphthalen-2-yl)-1H-indol-5-yl]ethanoic acid

Systemtic Name: 2-[3-(4-azanylbutyl)-2-(1-methoxynaphthalen-2-yl)-1H-indol-5-yl]ethanoic acid Openeye Name: 2-[3-(4-aminobutyl)-2-(1-methoxy-2-naphthyl)-1H-indol-5-yl]acetic acid CAS Name: 2-[3-(4-aminobutyl)-2-(1-methoxy-2-naphthalenyl)-1H-indol-5-yl]acetic acid IUPAC Name: 2-[3-(4-aminobutyl)-2-(1-methoxynaphthalen-2-yl)-1H-indol-5-yl]acetic acid Traditional Name: 2-[3-(4-aminobutyl)-2-(1-methoxy-2-naphthyl)-1H-indol-5-yl]acetic acid Formula: C25H26N2O3 MolecularWeight: 402.48554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC2=CC=CC=C21)C3=C(C4=C(N3)C=CC(=C4)CC(=O)O)CCCCN

Isomeric SMILES

COC1=C(C=CC2=CC=CC=C21)C3=C(C4=C(N3)C=CC(=C4)CC(=O)O)CCCCN

InChI

InChI=1S/C25H26N2O3/c1-30-25-18-7-3-2-6-17(18)10-11-20(25)24-19(8-4-5-13-26)21-14-16(15-23(28)29)9-12-22(21)27-24/h2-3,6-7,9-12,14,27H,4-5,8,13,15,26H2,1H3,(H,28,29)