(3S,4S)-3-chloranyl-4-(4-methylpiperazin-1-yl)-3-phenyl-5,6,7,8-tetrahydro-4H-chromen-2-one

Systemtic Name: (3S,4S)-3-chloranyl-4-(4-methylpiperazin-1-yl)-3-phenyl-5,6,7,8-tetrahydro-4H-chromen-2-one Openeye Name: (3S,4S)-3-chloro-4-(4-methylpiperazin-1-yl)-3-phenyl-5,6,7,8-tetrahydro-4H-chromen-2-one CAS Name: (3S,4S)-3-chloro-4-(4-methyl-1-piperazinyl)-3-phenyl-5,6,7,8-tetrahydro-4H-1-benzopyran-2-one IUPAC Name: (3S,4S)-3-chloro-4-(4-methylpiperazin-1-yl)-3-phenyl-5,6,7,8-tetrahydro-4H-chromen-2-one Traditional Name: (3S,4S)-3-chloro-4-(4-methylpiperazino)-3-phenyl-5,6,7,8-tetrahydro-4H-chromen-2-one Formula: C20H25ClN2O2 MolecularWeight: 360.8777

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2C3=C(CCCC3)OC(=O)C2(C4=CC=CC=C4)Cl

Isomeric SMILES

CN1CCN(CC1)[C@H]2C3=C(CCCC3)OC(=O)[C@@]2(C4=CC=CC=C4)Cl

InChI

InChI=1S/C20H25ClN2O2/c1-22-11-13-23(14-12-22)18-16-9-5-6-10-17(16)25-19(24)20(18,21)15-7-3-2-4-8-15/h2-4,7-8,18H,5-6,9-14H2,1H3/t18-,20-/m0/s1