ethanoic acid; 4-[(4-methyl-1-benzofuran-2-yl)methyl]piperidine

Systemtic Name: ethanoic acid; 4-[(4-methyl-1-benzofuran-2-yl)methyl]piperidine Openeye Name: acetic acid; 4-[(4-methylbenzofuran-2-yl)methyl]piperidine CAS Name: acetic acid; 4-[(4-methyl-2-benzofuranyl)methyl]piperidine IUPAC Name: acetic acid; 4-[(4-methyl-1-benzofuran-2-yl)methyl]piperidine Traditional Name: acetic acid; 4-[(4-methylbenzofuran-2-yl)methyl]piperidine Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(OC2=CC=C1)CC3CCNCC3.CC(=O)O

Isomeric SMILES

CC1=C2C=C(OC2=CC=C1)CC3CCNCC3.CC(=O)O

InChI

InChI=1S/C15H19NO.C2H4O2/c1-11-3-2-4-15-14(11)10-13(17-15)9-12-5-7-16-8-6-12;1-2(3)4/h2-4,10,12,16H,5-9H2,1H3;1H3,(H,3,4)