2-(2-oxidanylidene-3-prop-1-en-2-yl-benzimidazol-1-yl)ethyl 4-[propanoyl(pyridin-4-yl)amino]piperidine-1-carboxylate

Systemtic Name: 2-(2-oxidanylidene-3-prop-1-en-2-yl-benzimidazol-1-yl)ethyl 4-[propanoyl(pyridin-4-yl)amino]piperidine-1-carboxylate Openeye Name: 2-(3-isopropenyl-2-oxo-benzimidazol-1-yl)ethyl 4-[propanoyl(4-pyridyl)amino]piperidine-1-carboxylate CAS Name: 4-[1-oxopropyl(pyridin-4-yl)amino]-1-piperidinecarboxylic acid 2-[3-(1-methylethenyl)-2-oxo-1-benzimidazolyl]ethyl ester IUPAC Name: 2-(2-oxo-3-prop-1-en-2-ylbenzimidazol-1-yl)ethyl 4-[propanoyl(pyridin-4-yl)amino]piperidine-1-carboxylate Traditional Name: 4-[propionyl(4-pyridyl)amino]piperidine-1-carboxylic acid 2-(3-isopropenyl-2-keto-benzimidazol-1-yl)ethyl ester Formula: C26H31N5O4 MolecularWeight: 477.55544

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CCN(CC1)C(=O)OCCN2C3=CC=CC=C3N(C2=O)C(=C)C)C4=CC=NC=C4

Isomeric SMILES

CCC(=O)N(C1CCN(CC1)C(=O)OCCN2C3=CC=CC=C3N(C2=O)C(=C)C)C4=CC=NC=C4

InChI

InChI=1S/C26H31N5O4/c1-4-24(32)31(20-9-13-27-14-10-20)21-11-15-28(16-12-21)26(34)35-18-17-29-22-7-5-6-8-23(22)30(19(2)3)25(29)33/h5-10,13-14,21H,2,4,11-12,15-18H2,1,3H3