3-[(3S)-3-phenyl-3-(pyridin-3-ylmethylamino)propanoyl]chromen-2-one

Systemtic Name: 3-[(3S)-3-phenyl-3-(pyridin-3-ylmethylamino)propanoyl]chromen-2-one Openeye Name: 3-[(3S)-3-phenyl-3-(3-pyridylmethylamino)propanoyl]chromen-2-one CAS Name: 3-[(3S)-1-oxo-3-phenyl-3-(3-pyridinylmethylamino)propyl]-1-benzopyran-2-one IUPAC Name: 3-[(3S)-3-phenyl-3-(pyridin-3-ylmethylamino)propanoyl]chromen-2-one Traditional Name: 3-[(3S)-3-phenyl-3-(3-pyridylmethylamino)propanoyl]coumarin Formula: C24H20N2O3 MolecularWeight: 384.4272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)C2=CC3=CC=CC=C3OC2=O)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CC(=O)C2=CC3=CC=CC=C3OC2=O)NCC4=CN=CC=C4

InChI

InChI=1S/C24H20N2O3/c27-22(20-13-19-10-4-5-11-23(19)29-24(20)28)14-21(18-8-2-1-3-9-18)26-16-17-7-6-12-25-15-17/h1-13,15,21,26H,14,16H2/t21-/m0/s1