6-(2-ethylbutyl)-4-[[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]amino]chromen-2-one

Systemtic Name: 6-(2-ethylbutyl)-4-[[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]amino]chromen-2-one Openeye Name: 4-[[1-[(E)-cinnamyl]-4-piperidyl]amino]-6-(2-ethylbutyl)chromen-2-one CAS Name: 6-(2-ethylbutyl)-4-[[1-[(E)-3-phenylprop-2-enyl]-4-piperidinyl]amino]-1-benzopyran-2-one IUPAC Name: 6-(2-ethylbutyl)-4-[[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]amino]chromen-2-one Traditional Name: 4-[[1-[(E)-cinnamyl]-4-piperidyl]amino]-6-(2-ethylbutyl)coumarin Formula: C29H36N2O2 MolecularWeight: 444.60834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CC1=CC2=C(C=C1)OC(=O)C=C2NC3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

CCC(CC)CC1=CC2=C(C=C1)OC(=O)C=C2NC3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C29H36N2O2/c1-3-22(4-2)19-24-12-13-28-26(20-24)27(21-29(32)33-28)30-25-14-17-31(18-15-25)16-8-11-23-9-6-5-7-10-23/h5-13,20-22,25,30H,3-4,14-19H2,1-2H3/b11-8+