4-[[(E)-3-phenylprop-2-enyl]-piperidin-4-yl-amino]-6-thiophen-3-yl-chromen-2-one

Systemtic Name: 4-[[(E)-3-phenylprop-2-enyl]-piperidin-4-yl-amino]-6-thiophen-3-yl-chromen-2-one Openeye Name: 4-[[(E)-cinnamyl]-(4-piperidyl)amino]-6-(3-thienyl)chromen-2-one CAS Name: 4-[[(E)-3-phenylprop-2-enyl]-(4-piperidinyl)amino]-6-(3-thiophenyl)-1-benzopyran-2-one IUPAC Name: 4-[[(E)-3-phenylprop-2-enyl]-piperidin-4-ylamino]-6-thiophen-3-ylchromen-2-one Traditional Name: 4-[[(E)-cinnamyl]-(4-piperidyl)amino]-6-(3-thienyl)coumarin Formula: C27H26N2O2S MolecularWeight: 442.57254

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CC=CC2=CC=CC=C2)C3=CC(=O)OC4=C3C=C(C=C4)C5=CSC=C5

Isomeric SMILES

C1CNCCC1N(C/C=C/C2=CC=CC=C2)C3=CC(=O)OC4=C3C=C(C=C4)C5=CSC=C5

InChI

InChI=1S/C27H26N2O2S/c30-27-18-25(24-17-21(8-9-26(24)31-27)22-12-16-32-19-22)29(23-10-13-28-14-11-23)15-4-7-20-5-2-1-3-6-20/h1-9,12,16-19,23,28H,10-11,13-15H2/b7-4+