6-chloranyl-4-[[[(2R)-2-(furan-2-yl)-2-piperidin-1-yl-ethyl]amino]methyl]-7-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-[[[(2R)-2-(furan-2-yl)-2-piperidin-1-yl-ethyl]amino]methyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[[[(2R)-2-(2-furyl)-2-(1-piperidyl)ethyl]amino]methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[[(2R)-2-(2-furanyl)-2-(1-piperidinyl)ethyl]amino]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]amino]methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[[(2R)-2-(2-furyl)-2-piperidino-ethyl]amino]methyl]-7-methyl-coumarin Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNCC(C3=CC=CO3)N4CCCCC4)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC[C@H](C3=CC=CO3)N4CCCCC4)Cl

InChI

InChI=1S/C22H25ClN2O3/c1-15-10-21-17(12-18(15)23)16(11-22(26)28-21)13-24-14-19(20-6-5-9-27-20)25-7-3-2-4-8-25/h5-6,9-12,19,24H,2-4,7-8,13-14H2,1H3/t19-/m1/s1