(1S,6S)-6-[(4-tert-butylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6S)-6-[(4-tert-butylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6S)-6-[(4-tert-butylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6S)-6-[(4-tert-butylanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6S)-6-[(4-tert-butylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6S)-6-[(4-tert-butylphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2CC=CCC2C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC(=O)[C@H]2CC=CC[C@@H]2C(=O)O

InChI

InChI=1S/C18H23NO3/c1-18(2,3)12-8-10-13(11-9-12)19-16(20)14-6-4-5-7-15(14)17(21)22/h4-5,8-11,14-15H,6-7H2,1-3H3,(H,19,20)(H,21,22)/t14-,15-/m0/s1