(2-chloranyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate

Systemtic Name: (2-chloranyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate Openeye Name: (2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 4-(benzyloxycarbonylaminomethyl)cyclohexanecarboxylate CAS Name: 4-(phenylmethoxycarbonylaminomethyl)-1-cyclohexanecarboxylic acid (2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-3-yl) ester IUPAC Name: (2-chloro-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) 4-(phenylmethoxycarbonylaminomethyl)cyclohexane-1-carboxylate Traditional Name: 4-(benzyloxycarbonylaminomethyl)cyclohexanecarboxylic acid (2-chloro-6-keto-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl) ester Formula: C29H30ClNO6 MolecularWeight: 524.0046

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=CC(=C(C=C3OC2=O)OC(=O)C4CCC(CC4)CNC(=O)OCC5=CC=CC=C5)Cl

Isomeric SMILES

C1CCC2=C(C1)C3=CC(=C(C=C3OC2=O)OC(=O)C4CCC(CC4)CNC(=O)OCC5=CC=CC=C5)Cl

InChI

InChI=1S/C29H30ClNO6/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/h1-3,6-7,14-15,18,20H,4-5,8-13,16-17H2,(H,31,34)