ethyl 1-[(E)-3-(3-methoxy-6,7,8,9-tetrahydrodibenzofuran-2-yl)but-2-enoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[(E)-3-(3-methoxy-6,7,8,9-tetrahydrodibenzofuran-2-yl)but-2-enoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[(E)-3-(3-methoxy-6,7,8,9-tetrahydrodibenzofuran-2-yl)but-2-enoyl]piperidine-3-carboxylate CAS Name: 1-[(E)-3-(3-methoxy-6,7,8,9-tetrahydrodibenzofuran-2-yl)-1-oxobut-2-enyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(E)-3-(3-methoxy-6,7,8,9-tetrahydrodibenzofuran-2-yl)but-2-enoyl]piperidine-3-carboxylate Traditional Name: 1-[(E)-3-(3-methoxy-6,7,8,9-tetrahydrodibenzofuran-2-yl)but-2-enoyl]nipecotic acid ethyl ester Formula: C25H31NO5 MolecularWeight: 425.51734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C=C(C)C2=C(C=C3C(=C2)C4=C(O3)CCCC4)OC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)/C=C(\C)/C2=C(C=C3C(=C2)C4=C(O3)CCCC4)OC

InChI

InChI=1S/C25H31NO5/c1-4-30-25(28)17-8-7-11-26(15-17)24(27)12-16(2)19-13-20-18-9-5-6-10-21(18)31-23(20)14-22(19)29-3/h12-14,17H,4-11,15H2,1-3H3/b16-12+