[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 4-methyl-3-oxidanyl-benzoate

Systemtic Name: [2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl] 4-methyl-3-oxidanyl-benzoate Openeye Name: [2-[4-(1-naphthylmethyl)piperazin-1-yl]-2-oxo-ethyl] 3-hydroxy-4-methyl-benzoate CAS Name: 3-hydroxy-4-methylbenzoic acid [2-[4-(1-naphthalenylmethyl)-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-2-oxoethyl] 3-hydroxy-4-methylbenzoate Traditional Name: 3-hydroxy-4-methyl-benzoic acid [2-keto-2-[4-(1-naphthylmethyl)piperazino]ethyl] ester Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)CC3=CC=CC4=CC=CC=C43)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)N2CCN(CC2)CC3=CC=CC4=CC=CC=C43)O

InChI

InChI=1S/C25H26N2O4/c1-18-9-10-20(15-23(18)28)25(30)31-17-24(29)27-13-11-26(12-14-27)16-21-7-4-6-19-5-2-3-8-22(19)21/h2-10,15,28H,11-14,16-17H2,1H3