ethyl 4-[6-methyl-2-[1-[2-(pent-3-enoylamino)ethanoyl]piperidin-4-yl]pyridin-3-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-methyl-2-[1-[2-(pent-3-enoylamino)ethanoyl]piperidin-4-yl]pyridin-3-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[6-methyl-2-[1-[2-(pent-3-enoylamino)acetyl]-4-piperidyl]pyridine-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[6-methyl-2-[1-[1-oxo-2-(1-oxopent-3-enylamino)ethyl]-4-piperidinyl]-3-pyridinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-methyl-2-[1-[2-(pent-3-enoylamino)acetyl]piperidin-4-yl]pyridine-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[6-methyl-2-[1-[2-(pent-3-enoylamino)acetyl]-4-piperidyl]nicotinoyl]piperazine-1-carboxylic acid ethyl ester Formula: C26H37N5O5 MolecularWeight: 499.60248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)CNC(=O)CC=CC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(N=C(C=C2)C)C3CCN(CC3)C(=O)CNC(=O)CC=CC

InChI

InChI=1S/C26H37N5O5/c1-4-6-7-22(32)27-18-23(33)29-12-10-20(11-13-29)24-21(9-8-19(3)28-24)25(34)30-14-16-31(17-15-30)26(35)36-5-2/h4,6,8-9,20H,5,7,10-18H2,1-3H3,(H,27,32)