2,2-dimethyl-3-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]propanoic acid

Systemtic Name: 2,2-dimethyl-3-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]propanoic acid Openeye Name: 2,2-dimethyl-3-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidyl]propanoic acid CAS Name: 2,2-dimethyl-3-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)-1-piperidinyl]propanoic acid IUPAC Name: 2,2-dimethyl-3-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)piperidin-1-yl]propanoic acid Traditional Name: 2,2-dimethyl-3-[4-(8-methyl-6H-benzo[c][1]benzoxepin-11-ylidene)piperidino]propionic acid Formula: C25H29NO3 MolecularWeight: 391.50266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H29NO3/c1-17-8-9-20-19(14-17)15-29-22-7-5-4-6-21(22)23(20)18-10-12-26(13-11-18)16-25(2,3)24(27)28/h4-9,14H,10-13,15-16H2,1-3H3,(H,27,28)