(2-chloranyl-6-oxidanylidene-benzo[c]chromen-3-yl) 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate

Systemtic Name: (2-chloranyl-6-oxidanylidene-benzo[c]chromen-3-yl) 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate Openeye Name: (2-chloro-6-oxo-benzo[c]chromen-3-yl) 4-(benzyloxycarbonylaminomethyl)cyclohexanecarboxylate CAS Name: 4-(phenylmethoxycarbonylaminomethyl)-1-cyclohexanecarboxylic acid (2-chloro-6-oxo-3-benzo[c][1]benzopyranyl) ester IUPAC Name: (2-chloro-6-oxobenzo[c]chromen-3-yl) 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate Traditional Name: 4-(benzyloxycarbonylaminomethyl)cyclohexanecarboxylic acid (2-chloro-6-keto-benzo[c]chromen-3-yl) ester Formula: C29H26ClNO6 MolecularWeight: 519.97284

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)OCC2=CC=CC=C2)C(=O)OC3=C(C=C4C5=CC=CC=C5C(=O)OC4=C3)Cl

Isomeric SMILES

C1CC(CCC1CNC(=O)OCC2=CC=CC=C2)C(=O)OC3=C(C=C4C5=CC=CC=C5C(=O)OC4=C3)Cl

InChI

InChI=1S/C29H26ClNO6/c30-24-14-23-21-8-4-5-9-22(21)28(33)36-25(23)15-26(24)37-27(32)20-12-10-18(11-13-20)16-31-29(34)35-17-19-6-2-1-3-7-19/h1-9,14-15,18,20H,10-13,16-17H2,(H,31,34)