4-[4-[4-[(4-chlorophenyl)methylamino]piperidin-1-yl]-4-oxidanylidene-butoxy]-2-propan-2-ylidene-1-benzofuran-3-one

Systemtic Name: 4-[4-[4-[(4-chlorophenyl)methylamino]piperidin-1-yl]-4-oxidanylidene-butoxy]-2-propan-2-ylidene-1-benzofuran-3-one Openeye Name: 4-[4-[4-[(4-chlorophenyl)methylamino]-1-piperidyl]-4-oxo-butoxy]-2-isopropylidene-benzofuran-3-one CAS Name: 4-[4-[4-[(4-chlorophenyl)methylamino]-1-piperidinyl]-4-oxobutoxy]-2-propan-2-ylidene-3-benzofuranone IUPAC Name: 4-[4-[4-[(4-chlorophenyl)methylamino]piperidin-1-yl]-4-oxobutoxy]-2-propan-2-ylidene-1-benzofuran-3-one Traditional Name: 4-[4-[4-[(4-chlorobenzyl)amino]piperidino]-4-keto-butoxy]-2-isopropylidene-coumaran-3-one Formula: C27H31ClN2O4 MolecularWeight: 482.99904

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)C2=C(O1)C=CC=C2OCCCC(=O)N3CCC(CC3)NCC4=CC=C(C=C4)Cl)C

Isomeric SMILES

CC(=C1C(=O)C2=C(O1)C=CC=C2OCCCC(=O)N3CCC(CC3)NCC4=CC=C(C=C4)Cl)C

InChI

InChI=1S/C27H31ClN2O4/c1-18(2)27-26(32)25-22(5-3-6-23(25)34-27)33-16-4-7-24(31)30-14-12-21(13-15-30)29-17-19-8-10-20(28)11-9-19/h3,5-6,8-11,21,29H,4,7,12-17H2,1-2H3