7-methoxy-4-[[[(2S)-2-phenylbutyl]amino]methyl]chromen-2-one

Systemtic Name: 7-methoxy-4-[[[(2S)-2-phenylbutyl]amino]methyl]chromen-2-one Openeye Name: 7-methoxy-4-[[[(2S)-2-phenylbutyl]amino]methyl]chromen-2-one CAS Name: 7-methoxy-4-[[[(2S)-2-phenylbutyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[[[(2S)-2-phenylbutyl]amino]methyl]chromen-2-one Traditional Name: 7-methoxy-4-[[[(2S)-2-phenylbutyl]amino]methyl]coumarin Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNCC1=CC(=O)OC2=C1C=CC(=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](CNCC1=CC(=O)OC2=C1C=CC(=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H23NO3/c1-3-15(16-7-5-4-6-8-16)13-22-14-17-11-21(23)25-20-12-18(24-2)9-10-19(17)20/h4-12,15,22H,3,13-14H2,1-2H3/t15-/m1/s1