ethyl 2-[4-[3-oxidanylidene-2-(phenylmethyl)-4-(2-piperidin-4-ylethyl)piperazin-1-yl]phenoxy]ethanoate

Systemtic Name: ethyl 2-[4-[3-oxidanylidene-2-(phenylmethyl)-4-(2-piperidin-4-ylethyl)piperazin-1-yl]phenoxy]ethanoate Openeye Name: ethyl 2-[4-[2-benzyl-3-oxo-4-[2-(4-piperidyl)ethyl]piperazin-1-yl]phenoxy]acetate CAS Name: 2-[4-[3-oxo-2-(phenylmethyl)-4-[2-(4-piperidinyl)ethyl]-1-piperazinyl]phenoxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-[2-benzyl-3-oxo-4-(2-piperidin-4-ylethyl)piperazin-1-yl]phenoxy]acetate Traditional Name: 2-[4-[2-benzyl-3-keto-4-[2-(4-piperidyl)ethyl]piperazino]phenoxy]acetic acid ethyl ester Formula: C28H37N3O4 MolecularWeight: 479.61108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)COC1=CC=C(C=C1)N2CCN(C(=O)C2CC3=CC=CC=C3)CCC4CCNCC4

Isomeric SMILES

CCOC(=O)COC1=CC=C(C=C1)N2CCN(C(=O)C2CC3=CC=CC=C3)CCC4CCNCC4

InChI

InChI=1S/C28H37N3O4/c1-2-34-27(32)21-35-25-10-8-24(9-11-25)31-19-18-30(17-14-22-12-15-29-16-13-22)28(33)26(31)20-23-6-4-3-5-7-23/h3-11,22,26,29H,2,12-21H2,1H3