1-(cyclohexylmethyl)-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(cyclohexylmethyl)-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(cyclohexylmethyl)-N-[[(1S)-isochroman-1-yl]methyl]triazole-4-carboxamide CAS Name: 1-(cyclohexylmethyl)-N-[[(1S)-3,4-dihydro-1H-2-benzopyran-1-yl]methyl]-4-triazolecarboxamide IUPAC Name: 1-(cyclohexylmethyl)-N-[[(1S)-3,4-dihydro-1H-isochromen-1-yl]methyl]triazole-4-carboxamide Traditional Name: 1-(cyclohexylmethyl)-N-[[(1S)-isochroman-1-yl]methyl]triazole-4-carboxamide Formula: C20H26N4O2 MolecularWeight: 354.44604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C=C(N=N2)C(=O)NCC3C4=CC=CC=C4CCO3

Isomeric SMILES

C1CCC(CC1)CN2C=C(N=N2)C(=O)NC[C@@H]3C4=CC=CC=C4CCO3

InChI

InChI=1S/C20H26N4O2/c25-20(18-14-24(23-22-18)13-15-6-2-1-3-7-15)21-12-19-17-9-5-4-8-16(17)10-11-26-19/h4-5,8-9,14-15,19H,1-3,6-7,10-13H2,(H,21,25)/t19-/m1/s1