7-ethyl-4-[[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]amino]methyl]chromen-2-one

Systemtic Name: 7-ethyl-4-[[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]amino]methyl]chromen-2-one Openeye Name: 7-ethyl-4-[[[(2S)-2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]amino]methyl]chromen-2-one CAS Name: 7-ethyl-4-[[[(2S)-2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[[[(2S)-2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]amino]methyl]chromen-2-one Traditional Name: 7-ethyl-4-[[[(2S)-2-(4-methoxyphenyl)-2-piperidino-ethyl]amino]methyl]coumarin Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNCC(C3=CC=C(C=C3)OC)N4CCCCC4

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNC[C@H](C3=CC=C(C=C3)OC)N4CCCCC4

InChI

InChI=1S/C26H32N2O3/c1-3-19-7-12-23-21(16-26(29)31-25(23)15-19)17-27-18-24(28-13-5-4-6-14-28)20-8-10-22(30-2)11-9-20/h7-12,15-16,24,27H,3-6,13-14,17-18H2,1-2H3/t24-/m1/s1