(E)-3-[1-[(4-chlorophenyl)methyl]-5-phenylmethoxy-indol-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-[(4-chlorophenyl)methyl]-5-phenylmethoxy-indol-2-yl]prop-2-enoic acid Openeye Name: (E)-3-[5-benzyloxy-1-[(4-chlorophenyl)methyl]indol-2-yl]prop-2-enoic acid CAS Name: (E)-3-[1-[(4-chlorophenyl)methyl]-5-phenylmethoxy-2-indolyl]-2-propenoic acid IUPAC Name: (E)-3-[1-[(4-chlorophenyl)methyl]-5-phenylmethoxyindol-2-yl]prop-2-enoic acid Traditional Name: (E)-3-[5-benzoxy-1-(4-chlorobenzyl)indol-2-yl]acrylic acid Formula: C25H20ClNO3 MolecularWeight: 417.8842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC3=C(C=C2)N(C(=C3)C=CC(=O)O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC3=C(C=C2)N(C(=C3)/C=C/C(=O)O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H20ClNO3/c26-21-8-6-18(7-9-21)16-27-22(10-13-25(28)29)14-20-15-23(11-12-24(20)27)30-17-19-4-2-1-3-5-19/h1-15H,16-17H2,(H,28,29)/b13-10+