(1R,2S)-2-[2-(2-butoxynaphthalen-1-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: (1R,2S)-2-[2-(2-butoxynaphthalen-1-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: (1R,2S)-2-[2-(2-butoxy-1-naphthyl)ethylcarbamoyl]cyclohexanecarboxylic acid CAS Name: (1R,2S)-2-[[2-(2-butoxy-1-naphthalenyl)ethylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1R,2S)-2-[2-(2-butoxynaphthalen-1-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: (1R,2S)-2-[2-(2-butoxy-1-naphthyl)ethylcarbamoyl]cyclohexanecarboxylic acid Formula: C24H31NO4 MolecularWeight: 397.50724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C2=CC=CC=C2C=C1)CCNC(=O)C3CCCCC3C(=O)O

Isomeric SMILES

CCCCOC1=C(C2=CC=CC=C2C=C1)CCNC(=O)[C@H]3CCCC[C@H]3C(=O)O

InChI

InChI=1S/C24H31NO4/c1-2-3-16-29-22-13-12-17-8-4-5-9-18(17)19(22)14-15-25-23(26)20-10-6-7-11-21(20)24(27)28/h4-5,8-9,12-13,20-21H,2-3,6-7,10-11,14-16H2,1H3,(H,25,26)(H,27,28)/t20-,21+/m0/s1