(E)-3-(6-methoxy-3-methyl-7-oxidanyl-2-phenyl-1-propyl-indol-4-yl)-2-methyl-prop-2-enoic acid

Systemtic Name: (E)-3-(6-methoxy-3-methyl-7-oxidanyl-2-phenyl-1-propyl-indol-4-yl)-2-methyl-prop-2-enoic acid Openeye Name: (E)-3-(7-hydroxy-6-methoxy-3-methyl-2-phenyl-1-propyl-indol-4-yl)-2-methyl-prop-2-enoic acid CAS Name: (E)-3-(7-hydroxy-6-methoxy-3-methyl-2-phenyl-1-propyl-4-indolyl)-2-methyl-2-propenoic acid IUPAC Name: (E)-3-(7-hydroxy-6-methoxy-3-methyl-2-phenyl-1-propylindol-4-yl)-2-methylprop-2-enoic acid Traditional Name: (E)-3-(7-hydroxy-6-methoxy-3-methyl-2-phenyl-1-propyl-indol-4-yl)-2-methyl-acrylic acid Formula: C23H25NO4 MolecularWeight: 379.4489

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C2=C1C(=C(C=C2C=C(C)C(=O)O)OC)O)C)C3=CC=CC=C3

Isomeric SMILES

CCCN1C(=C(C2=C1C(=C(C=C2/C=C(\C)/C(=O)O)OC)O)C)C3=CC=CC=C3

InChI

InChI=1S/C23H25NO4/c1-5-11-24-20(16-9-7-6-8-10-16)15(3)19-17(12-14(2)23(26)27)13-18(28-4)22(25)21(19)24/h6-10,12-13,25H,5,11H2,1-4H3,(H,26,27)/b14-12+