2-[4-[1-(methylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-piperazin-2-yl]ethyl ethanoate

Systemtic Name: 2-[4-[1-(methylamino)-3-naphthalen-2-yl-1-oxidanylidene-propan-2-yl]-3-oxidanylidene-piperazin-2-yl]ethyl ethanoate Openeye Name: 2-[4-[2-(methylamino)-1-(2-naphthylmethyl)-2-oxo-ethyl]-3-oxo-piperazin-2-yl]ethyl acetate CAS Name: acetic acid 2-[4-[1-(methylamino)-3-(2-naphthalenyl)-1-oxopropan-2-yl]-3-oxo-2-piperazinyl]ethyl ester IUPAC Name: 2-[4-[1-(methylamino)-3-naphthalen-2-yl-1-oxopropan-2-yl]-3-oxopiperazin-2-yl]ethyl acetate Traditional Name: acetic acid 2-[3-keto-4-[2-keto-2-(methylamino)-1-(2-naphthylmethyl)ethyl]piperazin-2-yl]ethyl ester Formula: C22H27N3O4 MolecularWeight: 397.46748

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCC1C(=O)N(CCN1)C(CC2=CC3=CC=CC=C3C=C2)C(=O)NC

Isomeric SMILES

CC(=O)OCCC1C(=O)N(CCN1)C(CC2=CC3=CC=CC=C3C=C2)C(=O)NC

InChI

InChI=1S/C22H27N3O4/c1-15(26)29-12-9-19-22(28)25(11-10-24-19)20(21(27)23-2)14-16-7-8-17-5-3-4-6-18(17)13-16/h3-8,13,19-20,24H,9-12,14H2,1-2H3,(H,23,27)