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

Systemtic Name: 6-(3-chlorophenyl)-4-[[(E)-3-phenylprop-2-enyl]-piperidin-4-yl-amino]chromen-2-one Openeye Name: 6-(3-chlorophenyl)-4-[[(E)-cinnamyl]-(4-piperidyl)amino]chromen-2-one CAS Name: 6-(3-chlorophenyl)-4-[[(E)-3-phenylprop-2-enyl]-(4-piperidinyl)amino]-1-benzopyran-2-one IUPAC Name: 6-(3-chlorophenyl)-4-[[(E)-3-phenylprop-2-enyl]-piperidin-4-ylamino]chromen-2-one Traditional Name: 6-(3-chlorophenyl)-4-[[(E)-cinnamyl]-(4-piperidyl)amino]coumarin Formula: C29H27ClN2O2 MolecularWeight: 470.98988

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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=CC(=CC=C5)Cl

Isomeric SMILES

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

InChI

InChI=1S/C29H27ClN2O2/c30-24-10-4-9-22(18-24)23-11-12-28-26(19-23)27(20-29(33)34-28)32(25-13-15-31-16-14-25)17-5-8-21-6-2-1-3-7-21/h1-12,18-20,25,31H,13-17H2/b8-5+