2-(phenylmethoxycarbonylamino)ethyl 6-(1-butoxyethenyl)pyridine-3-carboxylate

Systemtic Name: 2-(phenylmethoxycarbonylamino)ethyl 6-(1-butoxyethenyl)pyridine-3-carboxylate Openeye Name: 2-(benzyloxycarbonylamino)ethyl 6-(1-butoxyvinyl)pyridine-3-carboxylate CAS Name: 6-(1-butoxyethenyl)-3-pyridinecarboxylic acid 2-(phenylmethoxycarbonylamino)ethyl ester IUPAC Name: 2-(phenylmethoxycarbonylamino)ethyl 6-(1-butoxyethenyl)pyridine-3-carboxylate Traditional Name: 6-(1-butoxyvinyl)nicotinic acid 2-(benzyloxycarbonylamino)ethyl ester Formula: C22H26N2O5 MolecularWeight: 398.45224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=C)C1=NC=C(C=C1)C(=O)OCCNC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCOC(=C)C1=NC=C(C=C1)C(=O)OCCNC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H26N2O5/c1-3-4-13-27-17(2)20-11-10-19(15-24-20)21(25)28-14-12-23-22(26)29-16-18-8-6-5-7-9-18/h5-11,15H,2-4,12-14,16H2,1H3,(H,23,26)