2-(2-azanylethyl)-4-(6-ethoxy-1-naphthalen-2-yl-hexyl)benzene-1,3-diol

Systemtic Name: 2-(2-azanylethyl)-4-(6-ethoxy-1-naphthalen-2-yl-hexyl)benzene-1,3-diol Openeye Name: 2-(2-aminoethyl)-4-[6-ethoxy-1-(2-naphthyl)hexyl]benzene-1,3-diol CAS Name: 2-(2-aminoethyl)-4-[6-ethoxy-1-(2-naphthalenyl)hexyl]benzene-1,3-diol IUPAC Name: 2-(2-aminoethyl)-4-(6-ethoxy-1-naphthalen-2-ylhexyl)benzene-1,3-diol Traditional Name: 2-(2-aminoethyl)-4-[6-ethoxy-1-(2-naphthyl)hexyl]resorcinol Formula: C26H33NO3 MolecularWeight: 407.54512

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCCCC(C1=CC2=CC=CC=C2C=C1)C3=C(C(=C(C=C3)O)CCN)O

Isomeric SMILES

CCOCCCCCC(C1=CC2=CC=CC=C2C=C1)C3=C(C(=C(C=C3)O)CCN)O

InChI

InChI=1S/C26H33NO3/c1-2-30-17-7-3-4-10-22(21-12-11-19-8-5-6-9-20(19)18-21)23-13-14-25(28)24(15-16-27)26(23)29/h5-6,8-9,11-14,18,22,28-29H,2-4,7,10,15-17,27H2,1H3