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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)OC(=O)C=C2N(CC=CC3=CC=CC=C3)C4CCNCC4

Isomeric SMILES

CCCCC1=CC2=C(C=C1)OC(=O)C=C2N(C/C=C/C3=CC=CC=C3)C4CCNCC4

InChI

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