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

Systemtic Name: 6-isocyano-4-[[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]amino]chromen-2-one Openeye Name: 4-[[1-[(E)-cinnamyl]-4-piperidyl]amino]-6-isocyano-chromen-2-one CAS Name: 6-isocyano-4-[[1-[(E)-3-phenylprop-2-enyl]-4-piperidinyl]amino]-1-benzopyran-2-one IUPAC Name: 6-isocyano-4-[[1-[(E)-3-phenylprop-2-enyl]piperidin-4-yl]amino]chromen-2-one Traditional Name: 4-[[1-[(E)-cinnamyl]-4-piperidyl]amino]-6-isocyano-coumarin Formula: C24H23N3O2 MolecularWeight: 385.45832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CC2=C(C=C1)OC(=O)C=C2NC3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

[C-]#[N+]C1=CC2=C(C=C1)OC(=O)C=C2NC3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O2/c1-25-20-9-10-23-21(16-20)22(17-24(28)29-23)26-19-11-14-27(15-12-19)13-5-8-18-6-3-2-4-7-18/h2-10,16-17,19,26H,11-15H2/b8-5+