(2Z)-5,6-diethoxy-2-[[1-(phenylmethyl)piperidin-4-yl]methylidene]-3H-inden-1-one

Systemtic Name: (2Z)-5,6-diethoxy-2-[[1-(phenylmethyl)piperidin-4-yl]methylidene]-3H-inden-1-one Openeye Name: (2Z)-2-[(1-benzyl-4-piperidyl)methylene]-5,6-diethoxy-indan-1-one CAS Name: (2Z)-5,6-diethoxy-2-[[1-(phenylmethyl)-4-piperidinyl]methylidene]-3H-inden-1-one IUPAC Name: (2Z)-2-[(1-benzylpiperidin-4-yl)methylidene]-5,6-diethoxy-3H-inden-1-one Traditional Name: (2Z)-2-[(1-benzyl-4-piperidyl)methylene]-5,6-diethoxy-indan-1-one Formula: C26H31NO3 MolecularWeight: 405.52924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(=CC3CCN(CC3)CC4=CC=CC=C4)C2=O)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C/C(=C/C3CCN(CC3)CC4=CC=CC=C4)/C2=O)OCC

InChI

InChI=1S/C26H31NO3/c1-3-29-24-16-21-15-22(26(28)23(21)17-25(24)30-4-2)14-19-10-12-27(13-11-19)18-20-8-6-5-7-9-20/h5-9,14,16-17,19H,3-4,10-13,15,18H2,1-2H3/b22-14-