3-[(3S)-3-[[(2S)-butan-2-yl]amino]-3-phenyl-propanoyl]chromen-2-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(CC(=O)C1=CC2=CC=CC=C2OC1=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C22H23NO3/c1-3-15(2)23-19(16-9-5-4-6-10-16)14-20(24)18-13-17-11-7-8-12-21(17)26-22(18)25/h4-13,15,19,23H,3,14H2,1-2H3/t15-,19-/m0/s1