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

Systemtic Name: 6-butyl-4-[[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]amino]chromen-2-one Openeye Name: 6-butyl-4-[[1-[(E)-cinnamyl]-4-piperidyl]amino]chromen-2-one CAS Name: 6-butyl-4-[[1-[(E)-3-phenylprop-2-enyl]-4-piperidinyl]amino]-1-benzopyran-2-one IUPAC Name: 6-butyl-4-[[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]amino]chromen-2-one Traditional Name: 6-butyl-4-[[1-[(E)-cinnamyl]-4-piperidyl]amino]coumarin Formula: C27H32N2O2 MolecularWeight: 416.55518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)OC(=O)C=C2NC3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC2=C(C=C1)OC(=O)C=C2NC3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H32N2O2/c1-2-3-8-22-12-13-26-24(19-22)25(20-27(30)31-26)28-23-14-17-29(18-15-23)16-7-11-21-9-5-4-6-10-21/h4-7,9-13,19-20,23,28H,2-3,8,14-18H2,1H3/b11-7+