but-2-ynyl 2-oxidanyl-2-[1-phenyl-4-(propylamino)cyclohexyl]ethanoate

Systemtic Name: but-2-ynyl 2-oxidanyl-2-[1-phenyl-4-(propylamino)cyclohexyl]ethanoate Openeye Name: but-2-ynyl 2-hydroxy-2-[1-phenyl-4-(propylamino)cyclohexyl]acetate CAS Name: 2-hydroxy-2-[1-phenyl-4-(propylamino)cyclohexyl]acetic acid but-2-ynyl ester IUPAC Name: but-2-ynyl 2-hydroxy-2-[1-phenyl-4-(propylamino)cyclohexyl]acetate Traditional Name: 2-hydroxy-2-[1-phenyl-4-(propylamino)cyclohexyl]acetic acid but-2-ynyl ester Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1CCC(CC1)(C2=CC=CC=C2)C(C(=O)OCC#CC)O

Isomeric SMILES

CCCNC1CCC(CC1)(C2=CC=CC=C2)C(C(=O)OCC#CC)O

InChI

InChI=1S/C21H29NO3/c1-3-5-16-25-20(24)19(23)21(17-9-7-6-8-10-17)13-11-18(12-14-21)22-15-4-2/h6-10,18-19,22-23H,4,11-16H2,1-2H3