ethyl 3-[4-(8-methoxy-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)piperidin-1-yl]propanoate

Systemtic Name: ethyl 3-[4-(8-methoxy-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)piperidin-1-yl]propanoate Openeye Name: ethyl 3-[4-(8-methoxy-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)-1-piperidyl]propanoate CAS Name: 3-[4-(8-methoxy-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)-1-piperidinyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[4-(8-methoxy-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)piperidin-1-yl]propanoate Traditional Name: 3-[4-(8-methoxy-5H-[1]benzoxepino[3,4-b]pyridin-11-ylidene)piperidino]propionic acid ethyl ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1CCC(=C2C3=C(COC4=C2C=CC(=C4)OC)N=CC=C3)CC1

Isomeric SMILES

CCOC(=O)CCN1CCC(=C2C3=C(COC4=C2C=CC(=C4)OC)N=CC=C3)CC1

InChI

InChI=1S/C24H28N2O4/c1-3-29-23(27)10-14-26-12-8-17(9-13-26)24-19-5-4-11-25-21(19)16-30-22-15-18(28-2)6-7-20(22)24/h4-7,11,15H,3,8-10,12-14,16H2,1-2H3