(Z)-3-[1-(cyclohexylmethyl)indol-5-yl]but-2-enoic acid

Systemtic Name: (Z)-3-[1-(cyclohexylmethyl)indol-5-yl]but-2-enoic acid Openeye Name: (Z)-3-[1-(cyclohexylmethyl)indol-5-yl]but-2-enoic acid CAS Name: (Z)-3-[1-(cyclohexylmethyl)-5-indolyl]-2-butenoic acid IUPAC Name: (Z)-3-[1-(cyclohexylmethyl)indol-5-yl]but-2-enoic acid Traditional Name: (Z)-3-[1-(cyclohexylmethyl)indol-5-yl]but-2-enoic acid Formula: C19H23NO2 MolecularWeight: 297.39142

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)O)C1=CC2=C(C=C1)N(C=C2)CC3CCCCC3

Isomeric SMILES

C/C(=C/C(=O)O)/C1=CC2=C(C=C1)N(C=C2)CC3CCCCC3

InChI

InChI=1S/C19H23NO2/c1-14(11-19(21)22)16-7-8-18-17(12-16)9-10-20(18)13-15-5-3-2-4-6-15/h7-12,15H,2-6,13H2,1H3,(H,21,22)/b14-11-