2,2-dimethyl-4-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]butanoic acid

Systemtic Name: 2,2-dimethyl-4-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]butanoic acid Openeye Name: 2,2-dimethyl-4-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidyl]butanoic acid CAS Name: 2,2-dimethyl-4-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidinyl]butanoic acid IUPAC Name: 2,2-dimethyl-4-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]butanoic acid Traditional Name: 2,2-dimethyl-4-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)piperidino]butyric acid Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C3CCN(CC3)CCC(C)(C)C(=O)O)C4=CC=CC=C4OC2

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C3CCN(CC3)CCC(C)(C)C(=O)O)C4=CC=CC=C4OC2

InChI

InChI=1S/C26H31NO3/c1-18-8-9-21-20(16-18)17-30-23-7-5-4-6-22(23)24(21)19-10-13-27(14-11-19)15-12-26(2,3)25(28)29/h4-9,16H,10-15,17H2,1-3H3,(H,28,29)