[(2S)-3-methyl-1-oxidanylidene-1-[2-(3-oxidanylpiperidin-1-yl)ethylamino]but-3-en-2-yl] 3-methoxy-5-methyl-naphthalene-1-carboxylate

Systemtic Name: [(2S)-3-methyl-1-oxidanylidene-1-[2-(3-oxidanylpiperidin-1-yl)ethylamino]but-3-en-2-yl] 3-methoxy-5-methyl-naphthalene-1-carboxylate Openeye Name: [(1S)-1-[2-(3-hydroxy-1-piperidyl)ethylcarbamoyl]-2-methyl-allyl] 3-methoxy-5-methyl-naphthalene-1-carboxylate CAS Name: 3-methoxy-5-methyl-1-naphthalenecarboxylic acid [(2S)-1-[2-(3-hydroxy-1-piperidinyl)ethylamino]-3-methyl-1-oxobut-3-en-2-yl] ester IUPAC Name: [(2S)-1-[2-(3-hydroxypiperidin-1-yl)ethylamino]-3-methyl-1-oxobut-3-en-2-yl] 3-methoxy-5-methylnaphthalene-1-carboxylate Traditional Name: 3-methoxy-5-methyl-naphthalene-1-carboxylic acid [(1S)-1-[2-(3-hydroxypiperidino)ethylcarbamoyl]-2-methyl-allyl] ester Formula: C25H32N2O5 MolecularWeight: 440.53198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C(C=C(C=C12)OC)C(=O)OC(C(=C)C)C(=O)NCCN3CCCC(C3)O

Isomeric SMILES

CC1=CC=CC2=C(C=C(C=C12)OC)C(=O)O[C@@H](C(=C)C)C(=O)NCCN3CCCC(C3)O

InChI

InChI=1S/C25H32N2O5/c1-16(2)23(24(29)26-10-12-27-11-6-8-18(28)15-27)32-25(30)22-14-19(31-4)13-21-17(3)7-5-9-20(21)22/h5,7,9,13-14,18,23,28H,1,6,8,10-12,15H2,2-4H3,(H,26,29)/t18?,23-/m0/s1