6-chloranyl-4-methyl-7-[2-oxidanylidene-2-[4-[(1S)-1-phenylethyl]piperazin-1-yl]ethoxy]chromen-2-one

Systemtic Name: 6-chloranyl-4-methyl-7-[2-oxidanylidene-2-[4-[(1S)-1-phenylethyl]piperazin-1-yl]ethoxy]chromen-2-one Openeye Name: 6-chloro-4-methyl-7-[2-oxo-2-[4-[(1S)-1-phenylethyl]piperazin-1-yl]ethoxy]chromen-2-one CAS Name: 6-chloro-4-methyl-7-[2-oxo-2-[4-[(1S)-1-phenylethyl]-1-piperazinyl]ethoxy]-1-benzopyran-2-one IUPAC Name: 6-chloro-4-methyl-7-[2-oxo-2-[4-[(1S)-1-phenylethyl]piperazin-1-yl]ethoxy]chromen-2-one Traditional Name: 6-chloro-7-[2-keto-2-[4-[(1S)-1-phenylethyl]piperazino]ethoxy]-4-methyl-coumarin Formula: C24H25ClN2O4 MolecularWeight: 440.9193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)C(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)N3CCN(CC3)[C@@H](C)C4=CC=CC=C4

InChI

InChI=1S/C24H25ClN2O4/c1-16-12-24(29)31-21-14-22(20(25)13-19(16)21)30-15-23(28)27-10-8-26(9-11-27)17(2)18-6-4-3-5-7-18/h3-7,12-14,17H,8-11,15H2,1-2H3/t17-/m0/s1