4b-(2-azanylethyl)-3-bromanyl-5,6,7,8,9,10-hexahydrophenanthren-8a-ol hydrochloride

Systemtic Name: 4b-(2-azanylethyl)-3-bromanyl-5,6,7,8,9,10-hexahydrophenanthren-8a-ol hydrochloride Openeye Name: 4b-(2-aminoethyl)-3-bromo-5,6,7,8,9,10-hexahydrophenanthren-8a-ol hydrochloride CAS Name: 4b-(2-aminoethyl)-3-bromo-5,6,7,8,9,10-hexahydrophenanthren-8a-ol hydrochloride IUPAC Name: 4b-(2-aminoethyl)-3-bromo-5,6,7,8,9,10-hexahydrophenanthren-8a-ol hydrochloride Traditional Name: 4b-(2-aminoethyl)-3-bromo-5,6,7,8,9,10-hexahydrophenanthren-8a-ol hydrochloride Formula: C16H23BrClNO MolecularWeight: 360.71692

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C3=C(CCC2(C1)O)C=CC(=C3)Br)CCN.Cl

Isomeric SMILES

C1CCC2(C3=C(CCC2(C1)O)C=CC(=C3)Br)CCN.Cl

InChI

InChI=1S/C16H22BrNO.ClH/c17-13-4-3-12-5-8-16(19)7-2-1-6-15(16,9-10-18)14(12)11-13;/h3-4,11,19H,1-2,5-10,18H2;1H