6-chloranyl-7-[4-[(4-phenylcyclohexyl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid

Systemtic Name: 6-chloranyl-7-[4-[(4-phenylcyclohexyl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Openeye Name: 6-chloro-7-[4-[(4-phenylcyclohexyl)carbamoyl]phenoxy]chromane-4-carboxylic acid CAS Name: 6-chloro-7-[4-[oxo-[(4-phenylcyclohexyl)amino]methyl]phenoxy]-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid IUPAC Name: 6-chloro-7-[4-[(4-phenylcyclohexyl)carbamoyl]phenoxy]-3,4-dihydro-2H-chromene-4-carboxylic acid Traditional Name: 6-chloro-7-[4-[(4-phenylcyclohexyl)carbamoyl]phenoxy]chroman-4-carboxylic acid Formula: C29H28ClNO5 MolecularWeight: 505.98932

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)OC4=C(C=C5C(CCOC5=C4)C(=O)O)Cl

Isomeric SMILES

C1CC(CCC1C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)OC4=C(C=C5C(CCOC5=C4)C(=O)O)Cl

InChI

InChI=1S/C29H28ClNO5/c30-25-16-24-23(29(33)34)14-15-35-26(24)17-27(25)36-22-12-8-20(9-13-22)28(32)31-21-10-6-19(7-11-21)18-4-2-1-3-5-18/h1-5,8-9,12-13,16-17,19,21,23H,6-7,10-11,14-15H2,(H,31,32)(H,33,34)