3-[(3R)-3-(butylamino)-3-phenyl-propanoyl]chromen-2-one

Systemtic Name: 3-[(3R)-3-(butylamino)-3-phenyl-propanoyl]chromen-2-one Openeye Name: 3-[(3R)-3-(butylamino)-3-phenyl-propanoyl]chromen-2-one CAS Name: 3-[(3R)-3-(butylamino)-1-oxo-3-phenylpropyl]-1-benzopyran-2-one IUPAC Name: 3-[(3R)-3-(butylamino)-3-phenylpropanoyl]chromen-2-one Traditional Name: 3-[(3R)-3-(butylamino)-3-phenyl-propanoyl]coumarin Formula: C22H23NO3 MolecularWeight: 349.42292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(CC(=O)C1=CC2=CC=CC=C2OC1=O)C3=CC=CC=C3

Isomeric SMILES

CCCCN[C@H](CC(=O)C1=CC2=CC=CC=C2OC1=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23NO3/c1-2-3-13-23-19(16-9-5-4-6-10-16)15-20(24)18-14-17-11-7-8-12-21(17)26-22(18)25/h4-12,14,19,23H,2-3,13,15H2,1H3/t19-/m1/s1