4-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]amino]methyl]-7-methoxy-coumarin Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NCC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)NCC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C23H27NO3/c1-5-16-6-8-17(9-7-16)23(15(2)3)24-14-18-12-22(25)27-21-13-19(26-4)10-11-20(18)21/h6-13,15,23-24H,5,14H2,1-4H3/t23-/m0/s1