(phenylmethyl) N-[[3-[3-(4-methanoylpiperazin-1-yl)propoxy]-4-methoxy-phenyl]methyl]carbamate

Systemtic Name: (phenylmethyl) N-[[3-[3-(4-methanoylpiperazin-1-yl)propoxy]-4-methoxy-phenyl]methyl]carbamate Openeye Name: benzyl N-[[3-[3-(4-formylpiperazin-1-yl)propoxy]-4-methoxy-phenyl]methyl]carbamate CAS Name: N-[[3-[3-(4-formyl-1-piperazinyl)propoxy]-4-methoxyphenyl]methyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[[3-[3-(4-formylpiperazin-1-yl)propoxy]-4-methoxyphenyl]methyl]carbamate Traditional Name: N-[3-[3-(4-formylpiperazino)propoxy]-4-methoxy-benzyl]carbamic acid benzyl ester Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)OCC2=CC=CC=C2)OCCCN3CCN(CC3)C=O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)OCC2=CC=CC=C2)OCCCN3CCN(CC3)C=O

InChI

InChI=1S/C24H31N3O5/c1-30-22-9-8-21(17-25-24(29)32-18-20-6-3-2-4-7-20)16-23(22)31-15-5-10-26-11-13-27(19-28)14-12-26/h2-4,6-9,16,19H,5,10-15,17-18H2,1H3,(H,25,29)