(4S)-1-oxidanylidene-2-(phenylmethyl)spiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxylate

Systemtic Name: (4S)-1-oxidanylidene-2-(phenylmethyl)spiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxylate Openeye Name: (4S)-2-benzyl-1-oxo-spiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxylate CAS Name: (4S)-1-oxo-2-(phenylmethyl)-4-spiro[4H-isoquinoline-3,1'-cyclopentane]carboxylate IUPAC Name: (4S)-2-benzyl-1-oxospiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxylate Traditional Name: (4S)-2-benzyl-1-keto-spiro[4H-isoquinoline-3,1'-cyclopentane]-4-carboxylate Formula: C21H20NO3- MolecularWeight: 334.3884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)C(C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C(=O)[O-]

Isomeric SMILES

C1CCC2(C1)[C@H](C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)C(=O)[O-]

InChI

InChI=1S/C21H21NO3/c23-19-17-11-5-4-10-16(17)18(20(24)25)21(12-6-7-13-21)22(19)14-15-8-2-1-3-9-15/h1-5,8-11,18H,6-7,12-14H2,(H,24,25)/p-1/t18-/m1/s1