1-(diheptylamino)-3-(1,2,3,4-tetrahydrophenanthren-9-yl)propan-2-ol chloride

Systemtic Name: 1-(diheptylamino)-3-(1,2,3,4-tetrahydrophenanthren-9-yl)propan-2-ol chloride Openeye Name: 1-(diheptylamino)-3-(1,2,3,4-tetrahydrophenanthren-9-yl)propan-2-ol chloride CAS Name: 1-(diheptylamino)-3-(1,2,3,4-tetrahydrophenanthren-9-yl)-2-propanol chloride IUPAC Name: 1-(diheptylamino)-3-(1,2,3,4-tetrahydrophenanthren-9-yl)propan-2-ol chloride Traditional Name: 1-(diheptylamino)-3-(1,2,3,4-tetrahydrophenanthren-9-yl)propan-2-ol chloride Formula: C31H49ClNO- MolecularWeight: 487.17986

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCCCCC)CC(CC1=CC2=C(CCCC2)C3=CC=CC=C31)O.[Cl-]

Isomeric SMILES

CCCCCCCN(CCCCCCC)CC(CC1=CC2=C(CCCC2)C3=CC=CC=C31)O.[Cl-]

InChI

InChI=1S/C31H49NO.ClH/c1-3-5-7-9-15-21-32(22-16-10-8-6-4-2)25-28(33)24-27-23-26-17-11-12-18-29(26)31-20-14-13-19-30(27)31;/h13-14,19-20,23,28,33H,3-12,15-18,21-22,24-25H2,1-2H3;1H/p-1