4-(cyclohexylamino)-1-[(3-phenyl-3,4-dihydro-2H-chromen-7-yl)oxy]butan-2-ol hydrochloride

Systemtic Name: 4-(cyclohexylamino)-1-[(3-phenyl-3,4-dihydro-2H-chromen-7-yl)oxy]butan-2-ol hydrochloride Openeye Name: 4-(cyclohexylamino)-1-(3-phenylchroman-7-yl)oxy-butan-2-ol hydrochloride CAS Name: 4-(cyclohexylamino)-1-[(3-phenyl-3,4-dihydro-2H-1-benzopyran-7-yl)oxy]-2-butanol hydrochloride IUPAC Name: 4-(cyclohexylamino)-1-[(3-phenyl-3,4-dihydro-2H-chromen-7-yl)oxy]butan-2-ol hydrochloride Traditional Name: 4-(cyclohexylamino)-1-(3-phenylchroman-7-yl)oxy-butan-2-ol hydrochloride Formula: C25H34ClNO3 MolecularWeight: 431.99536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NCCC(COC2=CC3=C(CC(CO3)C4=CC=CC=C4)C=C2)O.Cl

Isomeric SMILES

C1CCC(CC1)NCCC(COC2=CC3=C(CC(CO3)C4=CC=CC=C4)C=C2)O.Cl

InChI

InChI=1S/C25H33NO3.ClH/c27-23(13-14-26-22-9-5-2-6-10-22)18-28-24-12-11-20-15-21(17-29-25(20)16-24)19-7-3-1-4-8-19;/h1,3-4,7-8,11-12,16,21-23,26-27H,2,5-6,9-10,13-15,17-18H2;1H