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

Systemtic Name: 3-[(3S)-3-phenyl-3-(2-pyridin-2-ylethylamino)propanoyl]chromen-2-one Openeye Name: 3-[(3S)-3-phenyl-3-[2-(2-pyridyl)ethylamino]propanoyl]chromen-2-one CAS Name: 3-[(3S)-1-oxo-3-phenyl-3-[2-(2-pyridinyl)ethylamino]propyl]-1-benzopyran-2-one IUPAC Name: 3-[(3S)-3-phenyl-3-(2-pyridin-2-ylethylamino)propanoyl]chromen-2-one Traditional Name: 3-[(3S)-3-phenyl-3-[2-(2-pyridyl)ethylamino]propanoyl]coumarin Formula: C25H22N2O3 MolecularWeight: 398.45378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)C2=CC3=CC=CC=C3OC2=O)NCCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CC(=O)C2=CC3=CC=CC=C3OC2=O)NCCC4=CC=CC=N4

InChI

InChI=1S/C25H22N2O3/c28-23(21-16-19-10-4-5-12-24(19)30-25(21)29)17-22(18-8-2-1-3-9-18)27-15-13-20-11-6-7-14-26-20/h1-12,14,16,22,27H,13,15,17H2/t22-/m0/s1