2-[3-[[[(1S)-1-naphthalen-1-ylethyl]amino]methyl]phenoxy]ethyl 4-ethanoylpiperazine-1-carboxylate

Systemtic Name: 2-[3-[[[(1S)-1-naphthalen-1-ylethyl]amino]methyl]phenoxy]ethyl 4-ethanoylpiperazine-1-carboxylate Openeye Name: 2-[3-[[[(1S)-1-(1-naphthyl)ethyl]amino]methyl]phenoxy]ethyl 4-acetylpiperazine-1-carboxylate CAS Name: 4-acetyl-1-piperazinecarboxylic acid 2-[3-[[[(1S)-1-(1-naphthalenyl)ethyl]amino]methyl]phenoxy]ethyl ester IUPAC Name: 2-[3-[[[(1S)-1-naphthalen-1-ylethyl]amino]methyl]phenoxy]ethyl 4-acetylpiperazine-1-carboxylate Traditional Name: 4-acetylpiperazine-1-carboxylic acid 2-[3-[[[(1S)-1-(1-naphthyl)ethyl]amino]methyl]phenoxy]ethyl ester Formula: C28H33N3O4 MolecularWeight: 475.57932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)NCC3=CC(=CC=C3)OCCOC(=O)N4CCN(CC4)C(=O)C

Isomeric SMILES

C[C@@H](C1=CC=CC2=CC=CC=C21)NCC3=CC(=CC=C3)OCCOC(=O)N4CCN(CC4)C(=O)C

InChI

InChI=1S/C28H33N3O4/c1-21(26-12-6-9-24-8-3-4-11-27(24)26)29-20-23-7-5-10-25(19-23)34-17-18-35-28(33)31-15-13-30(14-16-31)22(2)32/h3-12,19,21,29H,13-18,20H2,1-2H3/t21-/m0/s1