2-[1-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]-1-oxidanylidene-propan-2-yl]-3-methylidene-isoindol-1-one

Systemtic Name: 2-[1-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]-1-oxidanylidene-propan-2-yl]-3-methylidene-isoindol-1-one Openeye Name: 2-[2-[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidyl]-1-methyl-2-oxo-ethyl]-3-methylene-isoindolin-1-one CAS Name: 2-[1-[4-[2-(4-ethoxyphenyl)ethyl]-1-piperidinyl]-1-oxopropan-2-yl]-3-methylene-1-isoindolone IUPAC Name: 2-[1-[4-[2-(4-ethoxyphenyl)ethyl]piperidin-1-yl]-1-oxopropan-2-yl]-3-methylideneisoindol-1-one Traditional Name: 2-[2-keto-1-methyl-2-[4-(2-p-phenetylethyl)piperidino]ethyl]-3-methylene-isoindolin-1-one Formula: C27H32N2O3 MolecularWeight: 432.55458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C(C)N3C(=C)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C(C)N3C(=C)C4=CC=CC=C4C3=O

InChI

InChI=1S/C27H32N2O3/c1-4-32-23-13-11-21(12-14-23)9-10-22-15-17-28(18-16-22)26(30)20(3)29-19(2)24-7-5-6-8-25(24)27(29)31/h5-8,11-14,20,22H,2,4,9-10,15-18H2,1,3H3